SCHEMBL4784785

SCHEMBL4784785

CCN1C(=O)N(C)c2cnc(Nc3cc(OC)ccc3Cl)nc2N1C1CCCC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 16/20 0.61
PLK3 Q9H4B4 5/20 0.61
TTK P33981 5/20 0.48
PRKDC P78527 2/20 0.48
CSF1R P07333 1/20 0.48
BRD4 O60885 7/20 0.45
ALK Q9UM73 2/20 0.45
PLK2 Q9NYY3 2/20 0.44
PRKD3 O94806 2/20 0.44
CLK2 P49760 2/20 0.44
PTK2 Q05397 2/20 0.44
CAMK2G Q13555 2/20 0.44
CAMK2D Q13557 2/20 0.44
PRKD2 Q9BZL6 2/20 0.44
CSNK1G1 Q9HCP0 2/20 0.44
CSNK1G3 Q9Y6M4 2/20 0.44
MAP4K4 O95819 1/20 0.44
PRKCG P05129 1/20 0.44
RPS6KA3 P51812 1/20 0.44
NEK4 P51957 1/20 0.44

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
SCHEMBL4731568 0.91 PLK1 (0.66) PLK1PLK3TTKPRKDCCSF1R
SCHEMBL4782668 0.90 PLK1 (0.72) PLK1PLK3TTKPRKDCCSF1R
SCHEMBL4783645 0.89 PLK1 (0.56) PLK1PLK3TTKBRD4ALK
SCHEMBL14220957 0.87 PLK1 (0.64) PLK1PLK3TTKBRD4ALK
SCHEMBL14220959 0.87 PLK1 (0.64) PLK1PLK3TTKBRD4ALK
SCHEMBL4905487 0.86 PLK1 (0.58) PLK1PLK3TTKBRD4ALK
SCHEMBL4781788 0.86 PLK1 (0.60) PLK1PLK3TTKBRD4ALK
SCHEMBL4780616 0.86 PLK1 (0.65) PLK1PLK3TTKBRD4ALK
SCHEMBL4781816 0.85 PLK1 (0.56) PLK1PLK3TTKBRD4ALK
SCHEMBL4784694 0.84 PLK1 (0.59) PLK1PLK3PRKDCCYP2C9CYP2C19

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