SCHEMBL4783883

SCHEMBL4783883

CCN1C(=O)N(C)c2cnc(Nc3cc(C)ccc3C)nc2N1C1CCCC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 15/20 0.59
PLK3 Q9H4B4 10/20 0.59
PLK2 Q9NYY3 7/20 0.46
PRKDC P78527 2/20 0.43
TTK P33981 2/20 0.43
PLK4 O00444 1/20 0.43
GAK O14976 1/20 0.43
STK33 Q9BYT3 1/20 0.43
BRD4 O60885 2/20 0.42
ALK Q9UM73 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
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

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
SCHEMBL4783021 0.89 PLK1 (0.66) PLK1PLK3PLK2TTKGAK
SCHEMBL4804359 0.89 PLK1 (0.59) PLK1PLK3PLK2TTKPLK4
SCHEMBL4846259 0.89 PLK1 (0.58) PLK1PLK3PLK2PRKDCTTK
SCHEMBL4782356 0.88 PLK1 (0.62) PLK1PLK3PLK2BRD4ALK
SCHEMBL4729390 0.87 PLK1 (0.56) PLK1PLK3PLK2BRD4
SCHEMBL4729262 0.86 PLK1 (0.56) PLK1PLK3PLK2PRKDCBRD4
SCHEMBL4782741 0.85 PLK1 (0.59) PLK1PLK3PLK2PRKDCTTK
SCHEMBL4798215 0.85 PLK1 (0.55) PLK1PLK3PLK2PRKDCBRD4
SCHEMBL4784151 0.85 PLK1 (0.56) PLK1PLK3PLK2BRD4PIP4K2A
SCHEMBL4779988 0.84 PLK1 (0.57) PLK1PLK3PLK2TTKPLK4

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