SCHEMBL4801699

SCHEMBL4801699

CCN1C(=O)N(C)c2cnc(Nc3ccc(N4CCN(Cc5ccccc5)CC4)cc3)nc2N1C1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 3/20 0.48
PLK3 Q9H4B4 2/20 0.48
DCLK1 O15075 1/20 0.47
LRRK2 Q5S007 1/20 0.47
CDK4 P11802 7/20 0.46
CCND1 P24385 7/20 0.46
CDK2 P24941 4/20 0.46
CDK6 Q00534 3/20 0.46
CDK9 P50750 3/20 0.46
CCNE1 P24864 3/20 0.46
CCNT1 O60563 2/20 0.46
CCND3 P30281 5/20 0.46
CCNA2 P20248 3/20 0.46
CCNK O75909 1/20 0.46
CCND2 P30279 4/20 0.45
GSK3B P49841 1/20 0.45
ACVR1 Q04771 1/20 0.45
PLK2 Q9NYY3 1/20 0.45
PKN1 Q16512 2/20 0.44
EGFR P00533 2/20 0.44

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
SCHEMBL4781952 0.86 CDK4 (0.53) PLK1PLK3DCLK1LRRK2CDK4
SCHEMBL4782067 0.86 PLK1 (0.52) PLK1PLK3DCLK1LRRK2PLK2
SCHEMBL4784197 0.86 PLK1 (0.56) PLK1PLK3CDK4CCND1CDK2
SCHEMBL4729386 0.84 PLK1 (0.53) PLK1PLK3DCLK1LRRK2PLK2
SCHEMBL4782475 0.83 PLK1 (0.54) PLK1PLK3PLK2MAPK9MARK3
SCHEMBL4800962 0.83 PLK1 (0.52) PLK1PLK3DCLK1LRRK2CDK4
SCHEMBL4729390 0.82 PLK1 (0.56) PLK1PLK3PLK2
SCHEMBL4782049 0.81 PLK1 (0.55) PLK1PLK3PLK2NUAK1MARK3
SCHEMBL14221001 0.81 PLK1 (0.54) PLK1PLK3PLK2
SCHEMBL4783060 0.80 PLK1 (0.49) PLK1PLK3DCLK1LRRK2PLK2

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