⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6142601 | 0.72 | — | — | |
| SCHEMBL12764990 | 0.56 | UGT2B7 (0.36) | — | |
| SCHEMBL19012249 | 0.55 | EPHX1 (0.33) | — | |
| SCHEMBL29949705 | 0.55 | GBA1 (0.31) | — | |
| SCHEMBL15580011 | 0.55 | — | — | |
| SCHEMBL27385851 | 0.54 | — | — | |
| SCHEMBL6907574 | 0.54 | CNR2 (0.36) | — | |
| SCHEMBL6907572 | 0.54 | CNR2 (0.36) | — | |
| SCHEMBL18523458 | 0.54 | — | — | |
| SCHEMBL27265511 | 0.52 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0078925-A1 | (+)- or (-)-7-Hydroxymethyl-2,6,6-trimethyltricyclo-(6,2,1,0 1,5) undecane, a process for producing them and a perfume composition | Takasago Perfumery Co., Ltd. (JP) | 1983-05-18 | — | — | EP | claimed |