⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8998598 | 1.00 | — | — | |
| SCHEMBL21571247 | 0.84 | MEN1 (0.35) | — | |
| SCHEMBL8998681 | 0.76 | KMT2A (0.52) | — | |
| SCHEMBL8998672 | 0.76 | KMT2A (0.52) | — | |
| SCHEMBL9344159 | 0.73 | — | — | |
| SCHEMBL9344162 | 0.73 | — | — | |
| SCHEMBL1472220 | 0.72 | KMT2A (0.48) | — | |
| SCHEMBL5312419 | 0.72 | KMT2A (0.48) | — | |
| SCHEMBL1472222 | 0.72 | KMT2A (0.48) | — | |
| SCHEMBL3047098 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0258967-B2 | Process for producing optically active alcohols | TAKASAGO PERFUMERY CO LTD (JP) | 1996-08-21 | — | — | EP | disclosed |
| US-4962242-A | HYDROGENATING OLEFINIC ALCOHOL USING AS CATALYST A RUTHENIUM-OPTICALLY ACTIVE PHOSPHINE COMPLEX | TAKASAGO PERFUMERY CO., LTD. (JP) | 1990-10-09 | — | — | US | disclosed |
| EP-0258967-A2 | Process for producing optically active alcohols | Takasago Perfumery Co., Ltd. (JP) | 1988-03-09 | — | — | EP | disclosed |