⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8183867 | 0.75 | — | — | |
| SCHEMBL8183864 | 0.75 | — | — | |
| SCHEMBL10545948 | 0.71 | — | — | |
| SCHEMBL7062360 | 0.66 | — | — | |
| SCHEMBL16605687 | 0.62 | — | — | |
| SCHEMBL3943421 | 0.60 | — | — | |
| SCHEMBL2168246 | 0.58 | — | — | |
| SCHEMBL17356130 | 0.58 | — | — | |
| SCHEMBL12869470 | 0.58 | — | — | |
| SCHEMBL8071572 | 0.56 | MEN1 (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4632930-A | Antihypertensive alkyl-arylimidazole, thiazole and oxazole derivatives | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1986-12-30 | — | — | US | disclosed |
| US-4472422-A | Antihypertensive 4,5-diaryl-α-polyfluoro-alkyl-1H-imidazole-2-methanamines | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-09-18 | — | — | US | disclosed |
| US-4348404-A | ANTIARTHRITIC | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-09-07 | — | — | US | disclosed |
| EP-0055471-A1 | Antiinflammatory 4,5-diaryl-alpha,alpha-bis(polyhalomethyl)-2-thiophenemethanamines | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-07-07 | — | — | EP | disclosed |
| EP-0044486-A1 | Antiinflammatory 4,5-diaryl-alpha-polyfluoroalkyl-1H-imidazole-2-methanamines | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-01-27 | — | — | EP | disclosed |