⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4621150 | 0.62 | — | — | |
| SCHEMBL27537073 | 0.59 | BCAT2 (0.30) | — | |
| SCHEMBL28242924 | 0.57 | — | — | |
| SCHEMBL27608425 | 0.57 | — | — | |
| SCHEMBL2926606 | 0.57 | — | — | |
| SCHEMBL7401606 | 0.57 | — | — | |
| SCHEMBL7130109 | 0.56 | — | — | |
| SCHEMBL7409156 | 0.55 | — | — | |
| SCHEMBL2842203 | 0.55 | — | — | |
| SCHEMBL565453 | 0.55 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE34423-E | For producing 4-benzoyl-5-hydroxypyrazoles | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1993-10-26 | — | — | US | disclosed |
| US-RE34408-E | Reacting carbon monoxide with a 5-hydroxy pyrazole and a substituted benzene | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1993-10-12 | — | — | US | disclosed |
| EP-0344775-B1 | PROCESS FOR PRODUCING 4-BENZOYL-5-HYDROXYPYRAZOLES | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1993-08-04 | — | — | EP | disclosed |
| US-5087724-A | For herbicides | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1992-02-11 | — | — | US | disclosed |
| US-4942246-A | CARBONYLATION, CONDENSATION, HERBICIDES | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1990-07-17 | — | — | US | disclosed |
| EP-0344775-A1 | Process for producing 4-benzoyl-5-hydroxypyrazoles | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1989-12-06 | — | — | EP | disclosed |