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SCHEMBL1521999

SCHEMBL1521999

Cc1cc(F)c(N)cc1-c1nc2cnc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccccc3)nc2n(C)c1=O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 17/20 0.52
▸ MAPK13 O15264 16/20 0.52
▸ MAPK12 P53778 16/20 0.52
▸ MAPK11 Q15759 16/20 0.52
▸ DDR2 Q16832 3/20 0.45
▸ BRAF P15056 1/20 0.45
▸ MAP3K7 O43318 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ TAB1 Q15750 1/20 0.44

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
SCHEMBL1521892 0.89 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL1893073 0.81 MAPK12 (0.42) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL1521998 0.80 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL1521775 0.80 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL5065309 0.78 BRAF (0.63) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL1521762 0.77 BRAF (0.43) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL1886078 0.74 CYP1A2 (0.47) MAPK14BRAFCYP3A4CYP2C9
SCHEMBL5061391 0.73 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL4425259 0.72 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL5057550 0.72 BRAF (0.61) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7897762-B2 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2011-03-01 — — US disclosed