⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16656728 | 0.93 | ALOX5 (0.52) | — | |
| SCHEMBL16656301 | 0.93 | ALOX5 (0.52) | — | |
| SCHEMBL16656311 | 0.93 | ALOX5 (0.52) | — | |
| SCHEMBL16656305 | 0.87 | ALOX5 (0.47) | — | |
| SCHEMBL16656731 | 0.87 | ALOX5 (0.47) | — | |
| SCHEMBL16656317 | 0.87 | ALOX5 (0.47) | — | |
| SCHEMBL12981294 | 0.84 | — | — | |
| SCHEMBL735585 | 0.79 | — | — | |
| SCHEMBL726033 | 0.78 | ALOX5 (0.61) | — | |
| SCHEMBL18685663 | 0.76 | ALOX5 (0.65) | — |
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-4440940-A | HYPOLIPIDEMIC AND ANTIATHEROSCLEROTIC AGENTS | AMERICAN CYANAMID COMPANY (US) | 1984-04-03 | — | — | US | disclosed |
| US-4281019-A | 4-[(Unsaturated or cyclopropylated alkyl)amino]phenyl compounds useful as hypolipidemic and antiatherosclerotic agents | AMERICAN CYANAMID COMPANY (US) | 1981-07-28 | — | — | US | disclosed |