SCHEMBL4689397

SCHEMBL4689397

CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(N)c3)cc2)n(-c2ccccc2)n1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.69
MAPK13 O15264 11/20 0.69
MAPK12 P53778 10/20 0.69
MAPK11 Q15759 10/20 0.69
BRAF P15056 4/20 0.67
FLT3 P36888 1/20 0.63
ABL1 P00519 2/20 0.63
AXL P30530 1/20 0.63
DDR2 Q16832 1/20 0.61
SRC P12931 1/20 0.61

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
SCHEMBL14538174 0.93 MAPK13 (0.76) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4648035 0.93 MAPK13 (0.79) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4691629 0.92 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4648911 0.92 MAPK13 (0.69) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4689912 0.91 MAPK13 (0.68) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4648837 0.91 MAPK14 (0.82) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4788187 0.90 MAPK13 (0.67) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4648598 0.90 MAPK13 (0.69) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4648248 0.89 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4785151 0.89 MAPK13 (0.65) MAPK14MAPK13MAPK12MAPK11BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960394-A2 PYRAZOLYL UREA DERIVATIVES USEFUL IN THE TREATMENT OF CANCER Bayer HealthCare AG (DE) 2008-08-27 EP disclosed
WO-2007059202-A2 PYRAZOLYL UREA DERIVATIVES USEFUL IN THE TREATMENT OF CANCER BAYER HEALTHCARE AG (DE) 2007-05-24 WO disclosed