SCHEMBL4784080

SCHEMBL4784080

CCN1C(=O)N(C)c2cnc(Nc3c(F)cccc3F)nc2N1C1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 14/20 0.54
PLK3 Q9H4B4 11/20 0.54
MAPK8 P45983 1/20 0.42
MAPK9 P45984 1/20 0.42
MAPK10 P53779 1/20 0.42
MAPK14 Q16539 1/20 0.42
PLK2 Q9NYY3 9/20 0.42
STK4 Q13043 4/20 0.40
BRD4 O60885 2/20 0.40
TTK P33981 2/20 0.39
PLK4 O00444 1/20 0.38
GAK O14976 1/20 0.38
STK33 Q9BYT3 1/20 0.38

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
SCHEMBL4779988 0.90 PLK1 (0.57) PLK1PLK3PLK2STK4BRD4
SCHEMBL14220999 0.90 PLK1 (0.56) PLK1PLK3PLK2STK4BRD4
SCHEMBL4782149 0.90 PLK1 (0.57) PLK1PLK3MAPK8MAPK9MAPK10
SCHEMBL4780676 0.88 PLK1 (0.54) PLK1PLK3PLK2BRD4TTK
SCHEMBL4782392 0.87 PLK1 (0.62) PLK1PLK3MAPK10PLK2BRD4
SCHEMBL4784197 0.85 PLK1 (0.56) PLK1PLK3PLK2BRD4
SCHEMBL4731448 0.85 PLK1 (0.54) PLK1PLK3PLK2BRD4
SCHEMBL14221013 0.85 PLK1 (0.54) PLK1PLK3PLK2BRD4TTK
SCHEMBL4730180 0.84 PLK1 (0.54) PLK1PLK3PLK2BRD4
SCHEMBL4782920 0.84 PLK1 (0.59) PLK1PLK3MAPK8MAPK9MAPK10

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