SCHEMBL5264038

SCHEMBL5264038

NC(=O)c1cccc(Oc2ncccc2-c2ccncn2)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.51
TNKS O95271 1/20 0.46
PARP15 Q460N3 1/20 0.46
PARP14 Q460N5 1/20 0.46
PARP10 Q53GL7 1/20 0.46
TNKS2 Q9H2K2 1/20 0.46
PARP2 Q9UGN5 1/20 0.46
KDR P35968 3/20 0.46
TEK Q02763 3/20 0.46
F10 P00742 3/20 0.42
PARP1 P09874 1/20 0.42
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
TPX2 Q9ULW0 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
F2 P00734 1/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL1265623 0.88 KDR (0.60) PDE10AKDRTEKAURKAAURKB
SCHEMBL1265217 0.83 KDR (0.59) PDE10AKDRTEKAURKAAURKB
SCHEMBL1265399 0.80 KDR (0.54) KDRTEKAURKAAURKBTPX2
SCHEMBL1266000 0.80 KDR (0.59) KDRTEKAURKAAURKBTPX2
SCHEMBL1265613 0.80 KDR (0.58) KDRTEKAURKAAURKBTPX2
SCHEMBL5261884 0.79 AURKB (0.63) KDRTEKAURKAAURKBTPX2
SCHEMBL1265692 0.79 TEK (0.75) KDRTEKAURKAAURKBTPX2
SCHEMBL1264020 0.79 TEK (0.49) PDE10AKDRTEKAURKAAURKB
SCHEMBL1268447 0.79 KDR (0.64) KDRTEKAURKAAURKBTPX2
SCHEMBL1264902 0.79 TEK (0.49) PDE10AKDRTEKAURKAAURKB

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-1751136-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2007-02-14 EP claimed
WO-2005113494-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2005-12-01 WO claimed