SCHEMBL6844484

SCHEMBL6844484

C=S(=O)(Nc1cnccc1-c1ncc2c(n1)N(C1CCCC1)CC(=O)N2C)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 11/20 0.39
BRD4 O60885 2/20 0.39
BRDT Q58F21 2/20 0.39
PRKDC P78527 3/20 0.39
ALK Q9UM73 1/20 0.38
PLK3 Q9H4B4 5/20 0.37
PLK2 Q9NYY3 4/20 0.37
STK4 Q13043 1/20 0.35
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
TTK P33981 5/20 0.33
FGFR4 P22455 1/20 0.33
RAD52 P43351 1/20 0.33
PLK4 O00444 1/20 0.32
GAK O14976 1/20 0.32
STK33 Q9BYT3 1/20 0.32

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
SCHEMBL6844374 0.87 PLK1 (0.44) PLK1BRD4BRDTPRKDCALK
SCHEMBL7743634 0.81 PLK1 (0.46) PLK1BRD4BRDTPRKDCALK
SCHEMBL6840300 0.79 PLK1 (0.48) PLK1BRD4BRDTPRKDCALK
SCHEMBL6840399 0.78 PLK1 (0.42) PLK1BRD4BRDTPRKDCALK
SCHEMBL2026196 0.75 PLK1 (0.65) PLK1BRD4PLK3PLK2
SCHEMBL2026198 0.75 PLK1 (0.65) PLK1BRD4PLK3PLK2
SCHEMBL16405234 0.73 PLK1 (0.40) PLK1BRD4BRDTPRKDCALK
SCHEMBL6910393 0.73 PLK1 (0.40) PLK1BRD4BRDTPRKDCALK
SCHEMBL16405175 0.73 PRKDC (0.42) PLK1BRD4BRDTPRKDCALK
SCHEMBL6844544 0.71 PLK1 (0.42) PLK1BRD4BRDTPRKDCALK

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-2011079118-A1 PTERIDINONES AS INHIBITORS OF POLO-LIKE KINASE ELAN PHARMACEUTICALS, INC (US) 2011-06-30 WO disclosed