SCHEMBL4781256

SCHEMBL4781256

CCN1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCNCC4)cc3OC)nc2N1C1CCCC1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 17/20 0.85
PLK3 Q9H4B4 5/20 0.85
BRD4 O60885 12/20 0.72
BRDT Q58F21 10/20 0.72
PLK2 Q9NYY3 2/20 0.66
PRKD3 O94806 3/20 0.65
CLK2 P49760 3/20 0.65
PTK2 Q05397 3/20 0.65
CAMK2G Q13555 3/20 0.65
CAMK2D Q13557 3/20 0.65
PRKD2 Q9BZL6 3/20 0.65
CSNK1G1 Q9HCP0 3/20 0.65
CSNK1G3 Q9Y6M4 3/20 0.65
MAP4K4 O95819 2/20 0.65
PRKCG P05129 2/20 0.65
RPS6KA3 P51812 2/20 0.65
NEK4 P51957 2/20 0.65
SRPK1 Q96SB4 1/20 0.65
DAPK3 O43293 2/20 0.62
CHEK2 O96017 2/20 0.62

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
SCHEMBL14221439 0.92 PLK1 (1.00) PLK1PLK3BRD4BRDTPLK2
SCHEMBL4731493 0.92 PLK1 (0.91) PLK1PLK3BRD4BRDTPLK2
SCHEMBL4843631 0.86 PLK1 (0.77) PLK1PLK3BRD4BRDTPLK2
SCHEMBL4781482 0.86 PLK1 (0.76) PLK1PLK3BRD4BRDTPLK2
SCHEMBL4784347 0.86 PLK1 (0.79) PLK1PLK3BRD4BRDTPLK2
SCHEMBL4734567 0.85 PLK1 (0.74) PLK1PLK3BRD4BRDTPLK2
SCHEMBL376821 0.84 PLK1 (0.92) PLK1PLK3BRD4BRDTPLK2
SCHEMBL30750574 0.84 PLK1 (0.92) PLK1PLK3BRD4BRDTPLK2
SCHEMBL1202746 0.84 PLK1 (0.86) PLK1PLK3BRD4BRDTPLK2
SCHEMBL4782668 0.83 PLK1 (0.72) PLK1PLK3BRD4BRDTPLK2

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