SCHEMBL4782849

SCHEMBL4782849

CCN1C(=O)N(C)c2cnc(Nc3cc(OC)cc(OC)c3)nc2N1C1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 17/20 0.60
PLK3 Q9H4B4 7/20 0.60
NUAK1 O60285 1/20 0.48
PIP4K2A P48426 1/20 0.45
PIP4K2B P78356 1/20 0.45
BRD4 O60885 6/20 0.44
FGFR4 P22455 1/20 0.44
PLK2 Q9NYY3 5/20 0.43
ALK Q9UM73 1/20 0.43
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
PRKCG P05129 1/20 0.42
CLK2 P49760 1/20 0.42
RPS6KA3 P51812 1/20 0.42
NEK4 P51957 1/20 0.42
PTK2 Q05397 1/20 0.42
CAMK2G Q13555 1/20 0.42
CAMK2D Q13557 1/20 0.42
SRPK1 Q96SB4 1/20 0.42
PRKD2 Q9BZL6 1/20 0.42

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
SCHEMBL4784694 0.91 PLK1 (0.59) PLK1PLK3
SCHEMBL4784001 0.90 PLK1 (0.61) PLK1PLK3NUAK1PIP4K2APIP4K2B
SCHEMBL4784151 0.89 PLK1 (0.56) PLK1PLK3NUAK1PIP4K2APIP4K2B
SCHEMBL4779878 0.88 PLK1 (0.54) PLK1PLK3PIP4K2APIP4K2BBRD4
SCHEMBL4730833 0.87 PLK1 (0.63) PLK1PLK3BRD4PLK2ALK
SCHEMBL4784233 0.87 PLK1 (0.62) PLK1PLK3BRD4PLK2ALK
SCHEMBL4782668 0.85 PLK1 (0.72) PLK1PLK3BRD4PLK2ALK
SCHEMBL4731379 0.85 PLK1 (0.59) PLK1PLK3BRD4PLK2ALK
SCHEMBL4729390 0.85 PLK1 (0.56) PLK1PLK3BRD4PLK2
SCHEMBL4784197 0.85 PLK1 (0.56) PLK1PLK3BRD4FGFR4PLK2

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