SmartChemistry® Generation: 
An accurate and fast Yield Prediction Modelling tool for Medicinal and Process Chemistry

It is used to generate high-quality experimental data – engineered to power reaction yield prediction models with over 90% accuracy.

Impact

Predict with confidence whether a chemical reaction will yield null, low, or high output – dramatically increasing success rates across industrial chemistry workflows and reducing wasted experimentation.

Intelligent Optimization

Machine Learning + Bayesian Optimization: Selects only the most informative, high-impact experiments to accelerate discovery and reduce costs.

Automated LC/MS Integration: Enables rapid experimental cycles through seamless analytical automation.

Our Goal

To achieve >90% predictive accuracy across the Top 20 pharmaceutical reactions, bringing unprecedented efficiency and precision to chemical R&D.

Where we are now

Proof-of-value successfully demonstrated on complex amide coupling reactions, showing strong potential for expansion across broader chemistries.