SCHEMBL935011

SCHEMBL935011

CC(C)(C)OC(=O)n1c(-c2cc(NC(=O)c3cnn(Cc4ccc(Cl)s4)c3)cn(COCC[Si](C)(C)C)c2=O)cc2cc(O)ccc21

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 2/20 0.34
RPS6KA2 Q15349 1/20 0.34
RPS6KA1 Q15418 1/20 0.34
RPS6KA6 Q9UK32 1/20 0.34
KLKB1 P03952 2/20 0.31
NR1H2 P55055 2/20 0.31
TTK P33981 3/20 0.31
SCD O00767 2/20 0.31
SCD5 Q86SK9 1/20 0.31
AURKA O14965 2/20 0.30
CCNA2 P20248 2/20 0.30
CDK2 P24941 2/20 0.30

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
SCHEMBL935596 0.93 NR1H2 (0.39) RPS6KA3RPS6KA2RPS6KA1RPS6KA6NR1H2
SCHEMBL935845 0.92 RPS6KA3 (0.33) RPS6KA3RPS6KA2RPS6KA1RPS6KA6KLKB1
SCHEMBL950118 0.90 RPS6KA3 (0.37) RPS6KA3RPS6KA2RPS6KA1RPS6KA6KLKB1
SCHEMBL936942 0.90 RPS6KA3 (0.31) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL1057502 0.89 RPS6KA3 (0.31) RPS6KA3RPS6KA2RPS6KA1RPS6KA6TTK
SCHEMBL952270 0.89 RPS6KA3 (0.36) RPS6KA3RPS6KA2RPS6KA1RPS6KA6KLKB1
SCHEMBL935188 0.88 DGAT1 (0.33) RPS6KA3RPS6KA2RPS6KA1RPS6KA6TTK
SCHEMBL12913263 0.86 RPS6KA3 (0.38) RPS6KA3RPS6KA2RPS6KA1RPS6KA6KLKB1
SCHEMBL935471 0.84 RPS6KA3 (0.45) RPS6KA3RPS6KA2RPS6KA1RPS6KA6NR1H2
SCHEMBL12913225 0.84 RPS6KA3 (0.37) RPS6KA3RPS6KA2RPS6KA1RPS6KA6KLKB1

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-2011010083-A1 INDOLYL-PYRIDONE DERIVATIVES VERNALIS (R & D) LTD (GB) 2011-01-27 WO disclosed