⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4485655 | 0.73 | — | — | |
| SCHEMBL11667178 | 0.69 | — | — | |
| SCHEMBL27740332 | 0.69 | — | — | |
| SCHEMBL9110286 | 0.69 | — | — | |
| SCHEMBL5052807 | 0.65 | — | — | |
| SCHEMBL6543860 | 0.65 | — | — | |
| SCHEMBL4992031 | 0.65 | — | — | |
| SCHEMBL11681863 | 0.63 | — | — | |
| SCHEMBL1937749 | 0.63 | — | — | |
| SCHEMBL6838112 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101331119-B | Benzoylpyrazole compounds and herbicides containing them | ISHIHARA SANGYO KAISHA | 2012-12-12 | — | — | CN | claimed |
| CN-102079723-B | Benzoylpyrazole compounds and herbicides containing them | ISHIHARA SANGYO KAISHA | 2013-04-17 | — | — | CN | disclosed |
| CN-101331119-B | Benzoylpyrazole compounds and herbicides containing them | ISHIHARA SANGYO KAISHA | 2012-12-12 | — | — | CN | disclosed |
| CN-1918129-B | Therapeutic agents | ASTRAZENECA AB | 2011-06-15 | — | — | CN | disclosed |
| CN-102079723-A | Benzoylpyrazole compounds and herbicides containing them | ISHIHARA SANGYO KAISHA | 2011-06-01 | — | — | CN | disclosed |
| CN-101331119-A | Benzoylpyrazole compounds and herbicides containing them | ISHIHARA SANGYO KAISHA (JP) | 2008-12-24 | — | — | CN | disclosed |
| CN-1918129-A | Therapeutic agents | ASTRAZENECA AB (SE) | 2007-02-21 | — | — | CN | disclosed |
| CN-1252065-C | Cinnoline compounds | ASTRAZENECA AB (SE) | 2006-04-19 | — | — | CN | disclosed |
| CN-1245402-C | indole derivatives, process for their preparation, pharmaceutical compositions containing them and their use | ASTRAZENECA AB (SE) | 2006-03-15 | — | — | CN | disclosed |
| CN-1468230-A | Compound (I) | — | 2004-01-14 | — | — | CN | disclosed |
| CN-1446214-A | Cinnoline compounds | ASTRAZENECA AB (SE) | 2003-10-01 | — | — | CN | disclosed |