⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28242924 | 0.69 | — | — | |
| SCHEMBL27461659 | 0.69 | — | — | |
| SCHEMBL9448452 | 0.62 | — | — | |
| SCHEMBL1986891 | 0.62 | — | — | |
| SCHEMBL27418285 | 0.62 | — | — | |
| SCHEMBL2926606 | 0.62 | — | — | |
| SCHEMBL565453 | 0.60 | — | — | |
| SCHEMBL1541650 | 0.59 | — | — | |
| SCHEMBL31388684 | 0.59 | — | — | |
| SCHEMBL3823525 | 0.59 | ALDH1A1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101072503-B | 3-cyclopropyl-4- (3-amino-2-methylbenzoyl) pyrazoles and their use as herbicides | BAYER CROPSCIENCE AG | 2013-03-27 | — | — | CN | disclosed |
| US-7396939-B2 | 3-cyclopropyl-4-(3-amino-2-methylbenzoyl)pyrazoles and their use as herbicides | BAYER CROPSCIENCE GMBH (DE) | 2008-07-08 | — | — | US | disclosed |
| EP-1824338-B1 | 3-CYCLOPROPYL-4-(3-AMINO-2-METHYLBENZOYL)PYRAZOLS AND THE USE OF THE SAME AS HERBICIDES | BAYER CROPSCIENCE AG (DE) | 2008-03-19 | — | — | EP | disclosed |
| CN-101072503-A | 3-cyclopropyl-4- (3-amino-2-methylbenzoyl) pyrazoles and their use as herbicides | BAYER CROPSCIENCE AG (DE) | 2007-11-14 | — | — | CN | disclosed |
| EP-1824338-A1 | 3-CYCLOPROPYL-4-(3-AMINO-2-METHYLBENZOYL)PYRAZOLS AND THE USE OF THE SAME AS HERBICIDES | Bayer CropScience AG (DE) | 2007-08-29 | — | — | EP | disclosed |
| US-20060128568-A1 | 3-cyclopropyl-4-(3-amino-2-methylbenzoyl)pyrazoles and their use as herbicides | BAYER CROPSCIENCE GMBH (DE) | 2006-06-15 | — | — | US | disclosed |
| WO-2006061074-A1 | 3-CYCLOPROPYL-4-(3-AMINO-2-METHYLBENZOYL)PYRAZOLS AND THE USE OF THE SAME AS HERBICIDES | BAYER CROPSCIENCE AG (DE) | 2006-06-15 | — | — | WO | disclosed |