SCHEMBL3050040

SCHEMBL3050040

C#CC([O])I

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL4776589 0.73
SCHEMBL2870228 0.67
SCHEMBL6852334 0.64
SCHEMBL83771 0.64
SCHEMBL9849929 0.64
SCHEMBL17729868 0.64
SCHEMBL5888581 0.64
SCHEMBL5888576 0.64
SCHEMBL18533140 0.64
SCHEMBL6939906 0.64

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 122 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101120000-B Pyrazolopyrimidines BAYER CROPSCIENCE AG 2011-05-18 CN claimed
US-20100222218-A1 INSECTICIDAL HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-09-02 US claimed
US-7781439-B2 Pyrazolopyrimidines BAYER CROPSCIENCE AG (DE) 2010-08-24 US claimed
US-7629294-B2 Pyrazolopyrimidines BAYER CROPSCIENCE LP (DE) 2009-12-08 US claimed
EP-2092824-A1 Heterocyclyl pyrimidines Bayer CropScience AG (DE) 2009-08-26 EP claimed
EP-2061319-A1 INSECTICIDAL HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES Bayer CropScience AG (DE) 2009-05-27 EP claimed
US-20080287463-A1 Pyrazolopyrimidines BAYER CROPSCIENCE AG (DE) 2008-11-20 US claimed
EP-1694681-B1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2008-03-12 EP claimed
WO-2008019723-A1 INSECTICIDAL HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2008-02-21 WO claimed
CN-101120000-A Pyrazolopyrimidines BAYER CROPSCIENCE AG (DE) 2008-02-06 CN claimed
EP-1694680-A1 PYRAZOLOPYRIMIDINES Bayer CropScience AG (DE) 2006-08-30 EP claimed
WO-2006087120-A2 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2006-08-24 WO claimed
WO-2005082907-A2 PYRAZOLOPYRIMIDINES FOR CONTROLLING UNDESIRED MICROORGANISMS BAYER CROPSCIENCE AG (DE) 2005-09-09 WO claimed
WO-2005077952-A1 IMIDAZOLOPYRIMIDINES USED AS FUNGICIDAL ACTIVE INGREDIENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-08-25 WO claimed
US-20050187224-A1 Pyrazolopyrimidines BAYER CROPSCIENCE AG (DE) 2005-08-25 US claimed
WO-2005061503-A1 TRIAZOLOPYRIMIDINES WITH FUNGICIDAL PROPERTIES BAYER CROPSCIENCE AG (DE) 2005-07-07 WO claimed
WO-2005056559-A1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-06-23 WO claimed
WO-2005056556-A1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-06-23 WO claimed
WO-2005056558-A1 PYRAZOLOPYRIMIDINES AS FUNGICIDAL ACTIVE INGREDIENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-06-23 WO claimed
WO-2005056555-A1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-06-23 WO claimed