⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL411486 | 1.00 | — | — | |
| SCHEMBL3674849 | 1.00 | — | — | |
| Ether SCHEMBL8349864 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL3378830 | 0.80 | EPHX1 (0.31) | — | |
| SCHEMBL2832724 | 0.80 | — | — | |
| SCHEMBL2829806 | 0.80 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL2639741 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL4217258 | 0.80 | — | — | |
| SCHEMBL31608595 | 0.78 | — | — | |
| SCHEMBL150393 | 0.77 | ALDH1A1 (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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1616852-B1 | PROCESS FOR PRODUCING BETA-HYDROXYESTER | DAISO CO LTD (JP) | 2010-08-11 | — | — | EP | disclosed |
| US-7256305-B2 | Process for producing β-hydroxyester | DAISO CO., LTD. (JP) | 2007-08-14 | — | — | US | disclosed |
| US-20060122419-A1 | Esterification of an epoxide, an alcohol and carbon monoxide in the presence of a cobalt carbonyl compound as catalyst and a cocatalyst of substituted pyridine | DAISO CO., LTD. (JP) | 2006-06-08 | — | — | US | disclosed |
| EP-1616852-A1 | PROCESS FOR PRODUCING BETA-HYDROXYESTER | DAISO CO., LTD. (JP) | 2006-01-18 | — | — | EP | disclosed |
| EP-0642416-A4 | FIBER/RESIN COMPOSITES AND METHOD OF PREPARATION. | LOCTITE CORP (US) | 1998-04-15 | — | — | EP | disclosed |
| EP-0642416-A1 | FIBER/RESIN COMPOSITES AND METHOD OF PREPARATION | LOCTITE CORPORATION (US) | 1995-03-15 | — | — | EP | disclosed |
| WO-1994021455-A1 | FIBER/RESIN COMPOSITES AND METHOD OF PREPARATION | LOCTITE CORPORATION (US) | 1994-09-29 | — | — | WO | disclosed |