SCHEMBL5586103

SCHEMBL5586103

Cc1cccc(-c2noc(NC(=O)Cc3cccc(C)c3C)c2-c2ccncn2)c1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.79
MAPK9 P45984 1/20 0.51
MAPK10 P53779 1/20 0.51
MAPK11 Q15759 1/20 0.51
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
P2RX7 Q99572 1/20 0.37
CYP3A4 P08684 1/20 0.35
PRKACA P17612 1/20 0.35
ROCK1 Q13464 1/20 0.35
KMO O15229 1/20 0.35

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
SCHEMBL1872761 0.94 MAPK14 (0.84) MAPK14MAPK9MAPK10MAPK11NPC1
SCHEMBL1877548 0.90 MAPK14 (0.81) MAPK14MAPK9MAPK10MAPK11NPC1
SCHEMBL1882877 0.90 MAPK14 (0.79) MAPK14MAPK9MAPK10MAPK11NPC1
SCHEMBL1877324 0.89 MAPK14 (1.00) MAPK14MAPK9MAPK10MAPK11
SCHEMBL1881717 0.89 MAPK14 (0.81) MAPK14MAPK9MAPK10MAPK11PRKACA
SCHEMBL1881306 0.89 MAPK14 (0.81) MAPK14MAPK9MAPK10MAPK11POLB
SCHEMBL5586148 0.88 MAPK14 (0.77) MAPK14MAPK9MAPK10MAPK11
SCHEMBL1876160 0.87 MAPK14 (0.76) MAPK14MAPK9MAPK10MAPK11CYP3A4
SCHEMBL1880979 0.87 MAPK14 (0.79) MAPK14MAPK9MAPK10MAPK11
SCHEMBL1884134 0.86 MAPK14 (0.77) MAPK14MAPK9MAPK10MAPK11CYP3A4

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
EP-1832584-A1 PYRIMIDINYLISOXAZOL DERIVATIVE ASKA Pharmaceutical Co., Ltd. (JP) 2007-09-12 EP disclosed