⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11065154 | 1.00 | — | — | |
| SCHEMBL11353095 | 0.85 | TSHR (0.30) | — | |
| SCHEMBL11353097 | 0.85 | TSHR (0.30) | — | |
| SCHEMBL11341460 | 0.84 | — | — | |
| SCHEMBL11341458 | 0.84 | — | — | |
| SCHEMBL11285768 | 0.80 | LCK (0.42) | — | |
| SCHEMBL11285766 | 0.80 | LCK (0.42) | — | |
| SCHEMBL11289310 | 0.78 | — | — | |
| SCHEMBL11289329 | 0.78 | — | — | |
| SCHEMBL537430 | 0.77 | — | — |
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-4230878-A | AND 4-(UNSATURATED ALKYL)AMINOBENZOIC ACIDS AND DERIVATIVES | AMERICAN CYANAMID COMPANY (US) | 1980-10-28 | — | — | US | disclosed |