SCHEMBL1646331

SCHEMBL1646331

Fc1ccc(-c2nn(Cc3cccc(F)c3F)cc2-c2ccncc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.52
CSNK1D P48730 2/20 0.52
CSNK1E P49674 2/20 0.52
MAPK13 O15264 2/20 0.52
MAPK12 P53778 2/20 0.52
MAPK11 Q15759 2/20 0.52
SRC P12931 2/20 0.46
BRAF P15056 2/20 0.46
KDR P35968 2/20 0.46
PTGS2 P35354 2/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL1646943 0.90 MAPK14 (0.54) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1645228 0.84 MAPK14 (0.53) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1650894 0.84 MAPK14 (0.50) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1646379 0.81 MAPK14 (0.53) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1644870 0.81 MAPK14 (0.65) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1647484 0.81 MAPK14 (0.65) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1645216 0.81 MAPK14 (0.49) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1645760 0.80 MAPK14 (0.60) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1646093 0.80 CSNK1D (0.53) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1646248 0.78 MAPK14 (0.58) MAPK14CSNK1DCSNK1EMAPK13MAPK12

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2784073-A1 3-PHENYL-4-PYRI(MI)DINYL-1H-PYRAZOLES AND THEIR USE AS FUNGICIDES Bayer CropScience AG (DE) 2014-10-01 EP disclosed
EP-2784071-A1 3-PHENYL-4-PYRI(MI)DINYL-1H-PYRAZOLES AND THEIR USE AS FUNGICIDES Bayer CropScience AG (DE) 2014-10-01 EP disclosed
EP-2784072-A1 3-PHENYL-4-PYRI(MI)DINYL-1H-PYRAZOLES AND THEIR USE AS FUNGICIDES Bayer CropScience AG (DE) 2014-10-01 EP disclosed
EP-2784070-A1 3-PHENYL-4-PYRI(MI)DINYL-1H-PYRAZOLES AND THEIR USE AS FUNGICIDES Bayer CropScience AG (DE) 2014-10-01 EP disclosed
EP-2308866-A1 Phenylpyri(mi)dinylpyrazoles and their use as fungicides Bayer CropScience AG (DE) 2011-04-13 EP disclosed