⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16209115 | 0.81 | CYP2C9 (0.31) | — | |
| SCHEMBL19511744 | 0.78 | TSHR (0.33) | — | |
| SCHEMBL360480 | 0.72 | — | — | |
| SCHEMBL13249316 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL20746533 | 0.69 | — | — | |
| SCHEMBL4731577 | 0.69 | — | — | |
| SCHEMBL6015010 | 0.67 | PRKCA (0.39) | — | |
| SCHEMBL19257464 | 0.67 | TSHR (0.41) | — | |
| SCHEMBL337832 | 0.67 | — | — | |
| SCHEMBL27782220 | 0.67 | TSHR (0.41) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130216518-A1 | COMPOSITION COMPRISING A COMBINATION OF AT LEAST ONE PROTEOLYTIC ENZYME AND AT LEAST ONE LIPOLYTIC ENZYME, FOR USE IN PREVENTING TRIGLYCERIDE SYNTHESIS | IMARKO RESEARCH S.A. (LU) | 2013-08-22 | — | — | US | disclosed |
| US-8362288-B2 | Process for preparing esters of alcohols and glycerin from triglycerides and alcohols using a heterogeneous catalyst in the presence of a controlled quantity of water | IFP Energies Nouvelles (FR) | 2013-01-29 | — | — | US | disclosed |
| US-20110065942-A1 | PROCESS FOR PREPARING ESTERS OF ALCOHOLS AND GLYCERIN FROM TRIGLYCERIDES AND ALCOHOLS USING A HETEROGENEOUS CATALYST IN THE PRESENCE OF A CONTROLLED QUANTITY OF WATER | IFP Energies Nouvelles (FR) | 2011-03-17 | — | — | US | disclosed |