SCHEMBL691659

SCHEMBL691659

CCCn1nc(C)cc1Nc1cc(Nc2ccccc2C(=O)NC)c(Cl)cn1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 2/20 0.59
MAPK3 P27361 2/20 0.52
MAPK1 P28482 2/20 0.52
MAPK10 P53779 7/20 0.49
MAPK9 P45984 6/20 0.49
MAPK8 P45983 1/20 0.48
TYK2 P29597 8/20 0.44
JAK2 O60674 7/20 0.44
JAK1 P23458 7/20 0.44
ULK1 O75385 1/20 0.43
KCNH2 Q12809 1/20 0.42
PDE4D Q08499 2/20 0.42

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
SCHEMBL693380 0.93 PTK2 (0.59) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL691087 0.93 PTK2 (0.60) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL690218 0.92 PTK2 (0.58) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL691296 0.91 PTK2 (0.56) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL692967 0.90 PTK2 (0.73) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL691570 0.90 PTK2 (0.56) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL691330 0.88 PTK2 (0.58) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL1292918 0.88 PTK2 (0.63) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL691756 0.84 PTK2 (0.59) PTK2MAPK3MAPK1MAPK10MAPK9
SCHEMBL690533 0.84 MAPK3 (0.55) PTK2MAPK3MAPK1MAPK10MAPK9

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-2421537-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GlaxoSmithKline LLC (US) 2012-02-29 EP claimed
WO-2010062578-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC (US) 2010-06-03 WO claimed