SCHEMBL1645973

SCHEMBL1645973

COCCOCCOCCn1cc(-c2ccncc2)c(-c2ccc(F)cc2)n1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.57
CSNK1D P48730 3/20 0.57
CSNK1E P49674 2/20 0.57
MAPK13 O15264 1/20 0.57
MAPK12 P53778 1/20 0.57
MAPK11 Q15759 1/20 0.57
BRAF P15056 2/20 0.52
MAPK3 P27361 1/20 0.52
MAPK1 P28482 1/20 0.52
MAP4K4 O95819 1/20 0.50
EGFR P00533 1/20 0.50
FRK P42685 1/20 0.50
MAPK9 P45984 1/20 0.50
SLK Q9H2G2 1/20 0.50
SLC6A3 Q01959 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SRC P12931 1/20 0.45
KDR P35968 1/20 0.45

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
SCHEMBL1646242 1.00 MAPK14 (0.57) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL12570357 0.93 CSNK1D (0.63) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1647012 0.93 CSNK1D (0.63) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL16105303 0.88 MAPK14 (0.60) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1648432 0.81 CSNK1D (0.56) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1892201 0.80 CSNK1D (0.65) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL6077523 0.80 CSNK1D (0.65) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL1386656 0.80 MAPK14 (0.45) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL12570387 0.79 CSNK1D (0.56) MAPK14CSNK1DCSNK1EMAPK13MAPK12
SCHEMBL12570404 0.79 CSNK1D (0.56) 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-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-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