⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2260752 | 0.69 | — | — | |
| SCHEMBL8167995 | 0.65 | — | — | |
| SCHEMBL3115191 | 0.65 | — | — | |
| SCHEMBL251279 | 0.65 | — | — | |
| SCHEMBL515462 | 0.65 | — | — | |
| SCHEMBL1355822 | 0.65 | — | — | |
| SCHEMBL5044080 | 0.65 | — | — | |
| SCHEMBL11357709 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL634374 | 0.63 | — | — | |
| Ammonia Solution, Strong SCHEMBL3667108 | 0.63 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1135388-A2 | 3-(HETEROCYCLYL)-SUBSTITUTED BENZOYLPYRAZOLS | BASF AKTIENGESELLSCHAFT (DE) | 2001-09-26 | — | — | EP | disclosed |
| EP-1135387-A2 | 3-(HETEROCYCLYL)-BENZOYLPYRAZOLE-DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 2001-09-26 | — | — | EP | disclosed |
| WO-2000034272-A2 | 3-(HETEROCYCLYL)-BENZOYLPYRAZOLE-DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 2000-06-15 | — | — | WO | disclosed |
| WO-2000034273-A2 | 3-(HETEROCYCLYL)-SUBSTITUTED BENZOYLPYRAZOLS | BASF AKTIENGESELLSCHAFT (DE) | 2000-06-15 | — | — | WO | disclosed |