⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4817448 | 0.91 | — | — | |
| SCHEMBL4815106 | 0.90 | — | — | |
| SCHEMBL4814345 | 0.87 | — | — | |
| SCHEMBL4819133 | 0.86 | — | — | |
| SCHEMBL4819604 | 0.86 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL4819120 | 0.82 | MAPT (0.32) | — | |
| SCHEMBL3604376 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL3602918 | 0.74 | TP53 (0.30) | — | |
| SCHEMBL3603003 | 0.72 | L3MBTL1 (0.33) | — | |
| SCHEMBL3603412 | 0.72 | GHSR (0.31) | — |
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-7465815-B2 | Cannabinoid receptor modulator | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-12-16 | — | — | US | disclosed |
| US-20070099990-A1 | Cannabinoid receptor modulator | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-05-03 | — | — | US | disclosed |