⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2711442 | 0.77 | — | — | |
| SCHEMBL2185428 | 0.69 | — | — | |
| SCHEMBL2185762 | 0.65 | — | — | |
| SCHEMBL9191419 | 0.65 | — | — | |
| SCHEMBL1792942 | 0.65 | — | — | |
| SCHEMBL989793 | 0.65 | — | — | |
| SCHEMBL4664906 | 0.65 | — | — | |
| SCHEMBL26641258 | 0.63 | — | — | |
| SCHEMBL1447877 | 0.62 | — | — | |
| SCHEMBL4262485 | 0.61 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1003736-B1 | SUBSTITUTED 4-BENZOYL-PYRAZOLES | BASF AG (DE) | 2006-04-12 | — | — | EP | claimed |
| US-6559100-B1 | Herbicidal activity of the substituted 2-benzoylcyclohexane-1,3-diones of the formula I was demonstrated by greenhouse experiments | BASF AKTIENGESELLSCHAFT (DE) | 2003-05-06 | — | — | US | claimed |
| EP-2343276-A1 | 2-Benzoyl-cyclohexan-1,3-diones as herbicides | BASF SE (DE) | 2011-07-13 | — | — | EP | disclosed |
| EP-1001939-B1 | HETEROCYCLIC SUBSTITUTED 4-BENZOYL-PYRAZOLE AS HERBICIDES | BASF SE (DE) | 2009-01-07 | — | — | EP | disclosed |
| EP-1003730-B1 | 2-BENZOYL-CYCLOHEXANE-1,3-DIONES | BASF AG (DE) | 2007-05-30 | — | — | EP | disclosed |
| EP-1003736-B1 | SUBSTITUTED 4-BENZOYL-PYRAZOLES | BASF AG (DE) | 2006-04-12 | — | — | EP | disclosed |
| US-6559100-B1 | Herbicidal activity of the substituted 2-benzoylcyclohexane-1,3-diones of the formula I was demonstrated by greenhouse experiments | BASF AKTIENGESELLSCHAFT (DE) | 2003-05-06 | — | — | US | disclosed |
| US-6432881-B1 | APPLYING TO PLANT, SEEDS, ENVIRONMENT; 2-BENZOYLCYCLOHEXANE-1,3-DIONE COMPOUND | BASF AKTIENGESELLSCHAFT (DE) | 2002-08-13 | — | — | US | disclosed |
| US-6207618-B1 | Heterocyclic substituted 4-benzoyl-pyrazole as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-27 | — | — | US | disclosed |
| US-6156702-A | Substituted 4-benzoylpyrazoles | BASF AKTIENGESELLSCHAFT (DE) | 2000-12-05 | — | — | US | disclosed |