⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9311445 | 0.93 | AGTR1 (0.33) | — | |
| SCHEMBL9859908 | 0.92 | AGTR1 (0.32) | — | |
| SCHEMBL9310018 | 0.91 | MAPK1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL9309853 | 0.91 | AGTR1 (0.31) | — | |
| SCHEMBL9309539 | 0.91 | AGTR1 (0.36) | — | |
| SCHEMBL8548762 | 0.91 | ABCB11 (0.30) | — | |
| SCHEMBL8548745 | 0.90 | AGTR1 (0.37) | — | |
| SCHEMBL9309706 | 0.89 | AGTR1 (0.40) | — | |
| SCHEMBL9309007 | 0.89 | AGTR1 (0.38) | — | |
| SCHEMBL8550462 | 0.89 | — | — |
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-0434249-A2 | Benzofuran derivatives | GLAXO GROUP LIMITED (GB) | 1991-06-26 | — | — | EP | claimed |
| US-5374646-A | Treatment or prophylasix of hypertension and diseases associated with cognitive disorders | GLAXO GROUP LIMITED (GB) | 1994-12-20 | — | — | US | disclosed |
| EP-0434249-A2 | Benzofuran derivatives | GLAXO GROUP LIMITED (GB) | 1991-06-26 | — | — | EP | disclosed |