SCHEMBL1648432

SCHEMBL1648432

Fc1ccc(-c2nn(CCOC(F)(F)F)cc2-c2ccncc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 2/20 0.56
CSNK1E P49674 2/20 0.56
MAPK13 O15264 1/20 0.56
MAPK12 P53778 1/20 0.56
MAPK11 Q15759 1/20 0.56
MAPK14 Q16539 1/20 0.56
BRAF P15056 3/20 0.52
SRC P12931 2/20 0.52
KDR P35968 2/20 0.52
PDE10A Q9Y233 1/20 0.45
SLC6A3 Q01959 1/20 0.44
MAPK3 P27361 1/20 0.44
MAPK1 P28482 1/20 0.44
PTGS2 P35354 1/20 0.43

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
SCHEMBL12570357 0.85 CSNK1D (0.63) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL1647012 0.85 CSNK1D (0.63) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL16105303 0.83 MAPK14 (0.60) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL6077523 0.82 CSNK1D (0.65) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL1892201 0.82 CSNK1D (0.65) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL1645973 0.81 MAPK14 (0.57) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL1646242 0.81 MAPK14 (0.57) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL1646015 0.81 MAPK14 (0.59) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL1648282 0.78 CSNK1D (0.59) CSNK1DCSNK1EMAPK13MAPK12MAPK11
SCHEMBL1645079 0.78 MAPK14 (0.63) CSNK1DCSNK1EMAPK13MAPK12MAPK11

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-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-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-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-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