⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10684677 | 1.00 | — | — | |
| SCHEMBL10679390 | 0.86 | LMNA (0.30) | — | |
| SCHEMBL10679402 | 0.86 | LMNA (0.30) | — | |
| SCHEMBL10685435 | 0.83 | LMNA (0.35) | — | |
| SCHEMBL10685449 | 0.83 | LMNA (0.35) | — | |
| SCHEMBL10683996 | 0.82 | HCAR2 (0.42) | — | |
| SCHEMBL10683990 | 0.82 | HCAR2 (0.42) | — | |
| SCHEMBL11107013 | 0.81 | ALOX15 (0.32) | — | |
| SCHEMBL9674283 | 0.79 | TSHR (0.31) | — | |
| SCHEMBL9674276 | 0.79 | TSHR (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4761420-A | CARDIOVASCULAR DISORDERS | LABORATOIRES SYNTEX S.A. (FR) | 1988-08-02 | — | — | US | disclosed |
| EP-0249245-A2 | Antihypertensive dihydropyridine derivatives | LABORATOIRES SYNTEX S.A. (FR) | 1987-12-16 | — | — | EP | disclosed |