⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22838792 | 0.88 | DAO (0.36) | — | |
| SCHEMBL1778746 | 0.78 | — | — | |
| SCHEMBL5713341 | 0.78 | DAO (0.50) | — | |
| SCHEMBL7038172 | 0.78 | FDPS (0.37) | — | |
| SCHEMBL7038176 | 0.78 | FDPS (0.37) | — | |
| SCHEMBL325049 | 0.77 | — | — | |
| SCHEMBL660757 | 0.77 | — | — | |
| SCHEMBL7100687 | 0.74 | DAO (0.43) | — | |
| SCHEMBL24494812 | 0.72 | MITF (0.36) | — | |
| SCHEMBL609885 | 0.72 | THRB (0.37) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57050967-A | — | — | None | — | — | JP | disclosed |
| CN-116813619-A | Macrocyclic inhibitors of Wee1 | 南京正大天晴制药有限公司 | 2023-09-29 | — | — | CN | disclosed |
| US-20090093491-A1 | Diazine Azole Derivatives, Their Manufacture and Use as Pharmaceutical | JENNI WOLFGANG | 2009-04-09 | — | — | US | disclosed |
| EP-1934210-A1 | DIAZINE AZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2008-06-25 | — | — | EP | disclosed |
| WO-2007039226-A1 | DIAZINE AZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-04-12 | — | — | WO | disclosed |
| JP-S5750967-A | PREPARATION OF 1-ALKYL-3-METHYLPYRAZOLE COMPOUND | ISHIHARA SANGYO KAISHA LTD | 1982-03-25 | — | — | JP | disclosed |
| US-4093792-A | Copolymerization product of N-vinylmethylpyrazole and divinyl cross-linking agent and method of preparing same | BRATSLAVSKAYA ALLA LVOVNA | 1978-06-06 | — | — | US | disclosed |