SCHEMBL4886676

SCHEMBL4886676

CCN1C(=O)N(C)c2cnc(Nc3cccc(NC(=O)c4ccccc4)c3)nc2N1C1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 8/20 0.56
PLK3 Q9H4B4 5/20 0.56
TNK2 Q07912 4/20 0.47
MAP4K2 Q12851 3/20 0.47
ABL1 P00519 2/20 0.46
BRD4 O60885 4/20 0.45
TAF1 P21675 2/20 0.45
PLK2 Q9NYY3 4/20 0.44
AURKA O14965 2/20 0.43
PLK4 O00444 1/20 0.43
LRRK2 Q5S007 1/20 0.43
AURKB Q96GD4 1/20 0.43
AURKC Q9UQB9 1/20 0.43
MAPK7 Q13164 2/20 0.43
DYRK1A Q13627 1/20 0.43
PARP1 P09874 1/20 0.43
CDK4 P11802 1/20 0.43
CCND1 P24385 1/20 0.43
SRC P12931 2/20 0.43
PRKD3 O94806 1/20 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
SCHEMBL4782583 0.90 PLK1 (0.55) PLK1PLK3ABL1BRD4TAF1
SCHEMBL4782722 0.89 PLK1 (0.60) PLK1PLK3BRD4TAF1PLK2
SCHEMBL4783506 0.88 PLK1 (0.57) PLK1PLK3BRD4TAF1PLK2
SCHEMBL4784197 0.87 PLK1 (0.56) PLK1PLK3BRD4TAF1PLK2
SCHEMBL4780462 0.87 PLK1 (0.53) PLK1PLK3BRD4PLK2AURKA
SCHEMBL4798215 0.86 PLK1 (0.55) PLK1PLK3BRD4PLK2AURKA
SCHEMBL4731562 0.85 PLK1 (0.54) PLK1PLK3BRD4PLK2PLK4
SCHEMBL4782678 0.85 PLK1 (0.57) PLK1PLK3BRD4TAF1PLK2
SCHEMBL4848371 0.84 PLK1 (0.69) PLK1PLK3ABL1BRD4TAF1
SCHEMBL4731693 0.84 PLK1 (0.54) PLK1PLK3ABL1BRD4PLK2

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
WO-2008040951-A1 COMPOUNDS ASTRAZENECA AB (SE) 2008-04-10 WO disclosed