⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27418918 | 0.89 | OPRM1 (0.30) | — | |
| SCHEMBL7863901 | 0.76 | — | — | |
| SCHEMBL7869287 | 0.76 | — | — | |
| SCHEMBL26880815 | 0.70 | — | — | |
| Ammonia Solution, Strong SCHEMBL27657393 | 0.69 | — | — | |
| SCHEMBL8373853 | 0.67 | — | — | |
| SCHEMBL7872980 | 0.65 | — | — | |
| SCHEMBL4452933 | 0.65 | — | — | |
| SCHEMBL901827 | 0.65 | — | — | |
| SCHEMBL6420177 | 0.65 | — | — |
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 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101353344-B | Pyrazolyl-substituted heterocycles and their use as phytosanitary products | BAYER CROPSCIENCE AG | 2012-07-11 | — | — | CN | disclosed |
| CN-100537551-C | Thiazolyl-substituted carbocyclic 1,3-diones as pesticidal agents | BAYER AG (DE) | 2009-09-09 | — | — | CN | disclosed |
| CN-100506806-C | [1,2]-oxazine-3, 5-dione compound | BAYER CROPSCIENCE AG (DE) | 2009-07-01 | — | — | CN | disclosed |
| CN-100503586-C | Difluoromethyl thiazolyl carboxanilides | BAYER CROPSCIENCE AG (DE) | 2009-06-24 | — | — | CN | disclosed |
| CN-100473651-C | Pyrazolyl-substituted heterocycles and their use as pest control agents | BAYER CROPSCIENCE AG (DE) | 2009-04-01 | — | — | CN | disclosed |
| CN-101353344-A | Pyrazolyl-substituted heterocycles and their use as phytosanitary products | BAYER CROPSCIENCE AG (DE) | 2009-01-28 | — | — | CN | disclosed |
| CN-100374424-C | Heterocyclic amide derivative and use as pesticide | BAYER CROPSCIENCE AG (DE) | 2008-03-12 | — | — | CN | disclosed |
| CN-100349891-C | Substituted 4-pyrazolyl pyrazolines for pest control agents | BAYER CROPSCIENCE AG (DE) | 2007-11-21 | — | — | CN | disclosed |
| CN-100338057-C | Halogenated nitrobutadienes for controlling animal pests | BAYER CROPSCIENCE AG (DE) | 2007-09-19 | — | — | CN | disclosed |
| CN-1319965-C | 2-heteroaryl-3, 4-dihydro-2H-pyrrole derivatives and their use as pesticides | BAYER CROP SCIENCE AG (DE) | 2007-06-06 | — | — | CN | disclosed |
| CN-1444564-A | Biphenyl carboxamides | BAYER CORPS SCIENCE AG (DE) | 2003-09-24 | — | — | CN | disclosed |
| CN-1113062-C | Dihydrofuran carboxamides | BAYER AG (DE) | 2003-07-02 | — | — | CN | disclosed |
| CN-1425013-A | Phenyl-substituted 4-hydroxy-tetrahydropyridones | BAYER AG (DE) | 2003-06-18 | — | — | CN | disclosed |
| CN-1353700-A | Isothiazole carboxamides and their use as microbicides | BAYER AGROCHEM KK (JP) | 2002-06-12 | — | — | CN | disclosed |
| EP-0719839-B1 | Phthalocyanine compounds and optical recording media comprising them | MITSUI CHEMICALS INC (JP) | 2001-07-25 | — | — | EP | disclosed |
| CN-1227551-A | N-sulfonylimidazoles used as fungicides | BAYER AG (DE) | 1999-09-01 | — | — | CN | disclosed |
| CN-1226244-A | Carbanilides as pesticides | BAYER AG (DE) | 1999-08-18 | — | — | CN | disclosed |
| CN-1226242-A | Dihydrofuran carboxamides | BAYER AG (DE) | 1999-08-18 | — | — | CN | disclosed |
| US-5693396-A | NEAR INFRARED LIGHT ABSORBERS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-12-02 | — | — | US | disclosed |
| EP-0719839-A2 | Phthalocyanine compounds and optical recording media comprising them | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-07-03 | — | — | EP | disclosed |