⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11322321 | 0.84 | — | — | |
| SCHEMBL5371710 | 0.80 | — | — | |
| SCHEMBL2916123 | 0.71 | — | — | |
| SCHEMBL6574938 | 0.71 | — | — | |
| SCHEMBL1137963 | 0.71 | — | — | |
| SCHEMBL5494891 | 0.69 | — | — | |
| SCHEMBL16215947 | 0.69 | — | — | |
| SCHEMBL14219167 | 0.67 | FDPS (0.36) | — | |
| SCHEMBL6015014 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL28580196 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |