⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL270401 | 0.78 | — | — | |
| SCHEMBL7822542 | 0.76 | TSHR (0.33) | — | |
| SCHEMBL1246110 | 0.75 | — | — | |
| SCHEMBL270130 | 0.74 | — | — | |
| SCHEMBL15904027 | 0.73 | GABRR1 (0.38) | — | |
| SCHEMBL269505 | 0.72 | — | — | |
| SCHEMBL15904353 | 0.70 | BHMT (0.33) | — | |
| SCHEMBL270182 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL270403 | 0.68 | — | — | |
| SCHEMBL270952 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8138177-B2 | Benzimidazolone derivatives as CB2 receptor ligands | PFIZER INC. (US) | 2012-03-20 | — | — | US | disclosed |
| EP-1861377-B1 | BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS | PFIZER (US) | 2010-12-29 | — | — | EP | disclosed |
| US-20090181957-A1 | BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS | ANDO KAZUO | 2009-07-16 | — | — | US | disclosed |