SCHEMBL5497318

SCHEMBL5497318

CCCN(C)c1cc2nc(-c3ccc(F)cc3)c(-c3ccncc3)c(-c3ccc(F)cc3)c2n1C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.43
MAPK10 P53779 1/20 0.40
MAPK13 O15264 3/20 0.40
MAPK12 P53778 3/20 0.40
MAPK11 Q15759 3/20 0.40
EGFR P00533 1/20 0.39
RAF1 P04049 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
ADORA1 P30542 1/20 0.39
GSK3B P49841 1/20 0.39
NAMPT P43490 1/20 0.38
CSNK1E P49674 2/20 0.38
CSNK1A1 P48729 1/20 0.38
CSNK1D P48730 1/20 0.38

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
SCHEMBL4412139 0.77 MAPK14 (0.48) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL4408102 0.76 MAPK14 (0.43) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL4408115 0.76 MAPK14 (0.47) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL4409918 0.74 MAPK14 (0.48) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL4408472 0.74 MAPK14 (0.48) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL4417406 0.73 NAMPT (0.45) MAPK14MAPK10NAMPTCSNK1ECSNK1D
SCHEMBL4410172 0.73 MAPK14 (0.47) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL4406497 0.73 MAPK14 (0.51) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL4410204 0.73 MAPK14 (0.46) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL4408106 0.72 MAPK14 (0.44) MAPK14MAPK10MAPK13MAPK12MAPK11

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-1833828-A2 CONDENSED PYRIDINES AS KINASE INHIBITORS Palau Pharma, S.A. (ES) 2007-09-19 EP claimed
WO-2006013095-A2 CONDENSED PYRIDINES AS KINASE INHIBITORS PALAU PHARMA, S.A. (ES) 2006-02-09 WO claimed