⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19445 | 0.86 | — | — | |
| SCHEMBL302981 | 0.86 | TSHR (0.55) | — | |
| SCHEMBL28424078 | 0.83 | — | — | |
| SCHEMBL6971580 | 0.83 | — | — | |
| SCHEMBL2765287 | 0.83 | — | — | |
| SCHEMBL1647546 | 0.83 | TSHR (0.52) | — | |
| SCHEMBL4632876 | 0.81 | TSHR (0.52) | — | |
| SCHEMBL11523839 | 0.81 | TSHR (0.52) | — | |
| SCHEMBL7478498 | 0.81 | TSHR (0.52) | — | |
| SCHEMBL615987 | 0.81 | TSHR (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |
| US-3962160-A | NOVEL ORGANOFUNCTIONAL (KETOXIMINO) SILANES AND ROOM TEMPERATURE, VULCANIZABLE COMPOSITIONS CONTAINING THE SAME | GENERAL ELECTRIC COMPANY (US) | 1976-06-08 | — | — | US | disclosed |