⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL28324348 | 0.94 | HIF1A (0.67) | — | |
| Piperazine SCHEMBL3157728 | 0.94 | — | — | |
| Pyrrolidine SCHEMBL3020399 | 0.85 | — | — | |
| Azetidine SCHEMBL791367 | 0.82 | — | — | |
| Azepane SCHEMBL5816622 | 0.82 | — | — | |
| Piperidine SCHEMBL1479664 | 0.82 | — | — | |
| SCHEMBL28437210 | 0.80 | HIF1A (0.86) | — | |
| Aziridine SCHEMBL30833516 | 0.80 | HIF1A (0.62) | — | |
| Piperazine SCHEMBL28236767 | 0.80 | — | — | |
| Aziridine SCHEMBL16878816 | 0.79 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6156940-A | Process for producing optically active carbinols | SUMIKA FINE CHEMICALS COMPANY, LIMITED (JP) | 2000-12-05 | — | — | US | disclosed |
| EP-0713848-B1 | Process for producing optically active carbinols | SUMIKA FINE CHEMICALS COMPANY (JP) | 1999-09-08 | — | — | EP | disclosed |
| US-5831132-A | REDUCING AGENT FROM BORANES AND AMINO ALCOHOLS | SUMIKA FINE CHEMICALS COMPANY, LTD. (JP) | 1998-11-03 | — | — | US | disclosed |
| EP-0713848-A1 | Process for producing optically active carbinols | SUMIKA FINE CHEMICALS Company, Limited (JP) | 1996-05-29 | — | — | EP | disclosed |