SCHEMBL4783877

SCHEMBL4783877

CCN1C(=O)N(C)c2cnc(Nc3ccc(NC(C)=O)c(C)c3)nc2N1C1CCCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 16/20 0.58
PLK3 Q9H4B4 12/20 0.58
PLK2 Q9NYY3 9/20 0.47
BRD4 O60885 4/20 0.43
MAPK7 Q13164 2/20 0.43
DYRK1A Q13627 1/20 0.43
TAF1 P21675 2/20 0.42
ALK Q9UM73 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
PRKCG P05129 1/20 0.41
CLK2 P49760 1/20 0.41
RPS6KA3 P51812 1/20 0.41
NEK4 P51957 1/20 0.41
PTK2 Q05397 1/20 0.41
CAMK2G Q13555 1/20 0.41
CAMK2D Q13557 1/20 0.41
SRPK1 Q96SB4 1/20 0.41
PRKD2 Q9BZL6 1/20 0.41
CSNK1G1 Q9HCP0 1/20 0.41

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
SCHEMBL4782583 0.88 PLK1 (0.55) PLK1PLK3PLK2BRD4MAPK7
SCHEMBL4729262 0.88 PLK1 (0.56) PLK1PLK3PLK2BRD4MAPK7
SCHEMBL4730180 0.85 PLK1 (0.54) PLK1PLK3PLK2BRD4MAPK7
SCHEMBL4781816 0.85 PLK1 (0.56) PLK1PLK3PLK2BRD4MAPK7
SCHEMBL4783694 0.84 PLK1 (0.54) PLK1PLK3PLK2BRD4MAPK7
SCHEMBL4782049 0.84 PLK1 (0.55) PLK1PLK3PLK2BRD4MAPK7
SCHEMBL4729390 0.83 PLK1 (0.56) PLK1PLK3PLK2BRD4MAPK7
SCHEMBL4731448 0.83 PLK1 (0.54) PLK1PLK3PLK2BRD4MAPK7
SCHEMBL1203295 0.83 PLK1 (0.58) PLK1PLK3BRD4ALKPLK4
SCHEMBL4784233 0.82 PLK1 (0.62) PLK1PLK3PLK2BRD4ALK

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