SCHEMBL4780676

SCHEMBL4780676

CCN1C(=O)N(C)c2cnc(Nc3cccc(F)c3Cl)nc2N1C1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 15/20 0.54
PLK3 Q9H4B4 13/20 0.54
BRD4 O60885 3/20 0.41
PLK2 Q9NYY3 11/20 0.40
FGFR4 P22455 1/20 0.40
EGFR P00533 1/20 0.40
PLK4 O00444 1/20 0.39
GAK O14976 1/20 0.39
TTK P33981 1/20 0.39
STK33 Q9BYT3 1/20 0.39
ALK Q9UM73 2/20 0.39
PIP4K2A P48426 1/20 0.39
PIP4K2B P78356 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
SCHEMBL14220999 0.91 PLK1 (0.56) PLK1PLK3BRD4PLK2FGFR4
SCHEMBL4782149 0.91 PLK1 (0.57) PLK1PLK3BRD4PLK2FGFR4
SCHEMBL14221013 0.90 PLK1 (0.54) PLK1PLK3BRD4PLK2FGFR4
SCHEMBL4784080 0.88 PLK1 (0.54) PLK1PLK3BRD4PLK2PLK4
SCHEMBL4781984 0.88 PLK1 (0.56) PLK1PLK3BRD4PLK2FGFR4
SCHEMBL4781955 0.86 PLK1 (0.58) PLK1PLK3BRD4PLK2PLK4
SCHEMBL4846259 0.86 PLK1 (0.58) PLK1PLK3BRD4PLK2FGFR4
SCHEMBL4905487 0.85 PLK1 (0.58) PLK1PLK3BRD4PLK2TTK
SCHEMBL4783645 0.84 PLK1 (0.56) PLK1PLK3BRD4PLK2PLK4
SCHEMBL4784278 0.84 PLK1 (0.58) PLK1PLK3BRD4PLK2PLK4

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