SCHEMBL4836402

SCHEMBL4836402

CCN1C(=O)N(C)c2cnc(Nc3ccc(-n4cncn4)cc3)nc2N1C1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 14/20 0.49
PLK3 Q9H4B4 10/20 0.49
PLK2 Q9NYY3 9/20 0.45
SYK P43405 1/20 0.44
TBK1 Q9UHD2 1/20 0.42
MAPK7 Q13164 1/20 0.41
DYRK1A Q13627 1/20 0.41
BRD4 O60885 3/20 0.41
TAF1 P21675 2/20 0.41
DCLK1 O15075 1/20 0.39
LRRK2 Q5S007 1/20 0.39
TTK P33981 1/20 0.39
PDGFRA P16234 1/20 0.39

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
SCHEMBL4783060 0.87 PLK1 (0.49) PLK1PLK3PLK2SYKMAPK7
SCHEMBL4729390 0.86 PLK1 (0.56) PLK1PLK3PLK2MAPK7DYRK1A
SCHEMBL4800962 0.84 PLK1 (0.52) PLK1PLK3PLK2MAPK7DYRK1A
SCHEMBL14221001 0.84 PLK1 (0.54) PLK1PLK3PLK2MAPK7DYRK1A
SCHEMBL4784197 0.84 PLK1 (0.56) PLK1PLK3PLK2MAPK7DYRK1A
SCHEMBL4781952 0.83 CDK4 (0.53) PLK1PLK3PLK2DCLK1LRRK2
SCHEMBL4782907 0.83 PLK1 (0.53) PLK1PLK3PLK2MAPK7DYRK1A
SCHEMBL4782801 0.83 PLK1 (0.53) PLK1PLK3PLK2MAPK7DYRK1A
SCHEMBL4729386 0.83 PLK1 (0.53) PLK1PLK3PLK2MAPK7DYRK1A
SCHEMBL4779668 0.83 PLK1 (0.53) PLK1PLK3PLK2MAPK7DYRK1A

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