SCHEMBL4782722

SCHEMBL4782722

CCN1C(=O)N(C)c2cnc(Nc3cccc(C(=O)NC)c3)nc2N1C1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 7/20 0.60
PLK3 Q9H4B4 6/20 0.60
PLK2 Q9NYY3 4/20 0.48
ALK Q9UM73 2/20 0.47
INSR P06213 1/20 0.47
PTK2 Q05397 2/20 0.44
BRD4 O60885 2/20 0.44
TAF1 P21675 1/20 0.44
PARP1 P09874 1/20 0.44
SCN9A Q15858 7/20 0.43
AURKA O14965 1/20 0.43
PRKD3 O94806 1/20 0.43
MAP4K4 O95819 1/20 0.43
PRKCG P05129 1/20 0.43
CLK2 P49760 1/20 0.43
RPS6KA3 P51812 1/20 0.43
NEK4 P51957 1/20 0.43
CAMK2G Q13555 1/20 0.43
CAMK2D Q13557 1/20 0.43
SRPK1 Q96SB4 1/20 0.43

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
SCHEMBL4783506 0.91 PLK1 (0.57) PLK1PLK3PLK2ALKBRD4
SCHEMBL4886676 0.89 PLK1 (0.56) PLK1PLK3PLK2BRD4TAF1
SCHEMBL4798215 0.87 PLK1 (0.55) PLK1PLK3PLK2BRD4PARP1
SCHEMBL4782583 0.87 PLK1 (0.55) PLK1PLK3PLK2BRD4TAF1
SCHEMBL4731693 0.85 PLK1 (0.54) PLK1PLK3PLK2BRD4PARP1
SCHEMBL4730395 0.85 PLK1 (0.54) PLK1PLK3PLK2BRD4PARP1
SCHEMBL4779460 0.85 PLK1 (0.54) PLK1PLK3PLK2BRD4PARP1
SCHEMBL4784197 0.85 PLK1 (0.56) PLK1PLK3PLK2BRD4TAF1
SCHEMBL4780462 0.85 PLK1 (0.53) PLK1PLK3PLK2BRD4PARP1
SCHEMBL4784694 0.85 PLK1 (0.59) PLK1PLK3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008040951-A1 COMPOUNDS ASTRAZENECA AB (SE) 2008-04-10 WO disclosed
WO-2008040951-A1 COMPOUNDS ASTRAZENECA AB (SE) 2008-04-10 WO disclosed