⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11251163 | 0.95 | HMOX1 (0.51) | — | |
| SCHEMBL11233877 | 0.92 | HMOX1 (0.53) | — | |
| SCHEMBL11237096 | 0.89 | HMOX1 (0.57) | — | |
| SCHEMBL11244464 | 0.89 | HMOX1 (0.52) | — | |
| SCHEMBL11252131 | 0.88 | HMOX1 (0.58) | — | |
| SCHEMBL11239799 | 0.87 | HMOX1 (0.58) | — | |
| SCHEMBL11248928 | 0.87 | HMOX1 (0.50) | — | |
| SCHEMBL11236032 | 0.86 | HMOX1 (0.67) | — | |
| SCHEMBL11250889 | 0.84 | HMOX1 (0.57) | — | |
| SCHEMBL11238358 | 0.84 | HMOX1 (0.59) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4338445-A | N-(Carbonylamino)-tetrahydropyridyl derivatives | CANADIAN PATENTS & DEVELOPMENT LIMITED (CA) | 1982-07-06 | — | — | US | disclosed |
| EP-0049565-A2 | Derivatives of substituted N-alkylimidazoles, their preparation and pharmaceutical compositions containing them | SYNTEX (U.S.A.) INC. (US) | 1982-04-14 | — | — | EP | disclosed |
| US-4321272-A | Derivatives of substituted N-alkylimidazoles | SYNTEX (U.S.A.) INC. (US) | 1982-03-23 | — | — | US | disclosed |