SCHEMBL11440877

SCHEMBL11440877

Cc1ccc(N)c(C(=O)Nc2ccc(S(=O)(=O)O)c3cccc(O)c23)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKB Q96GD4 2/20 0.55
▸ AURKA O14965 1/20 0.55
▸ PRKD3 O94806 2/20 0.42
▸ NR4A1 P22736 1/20 0.42
▸ CDC7 O00311 1/20 0.42
▸ EEF2K O00418 1/20 0.42
▸ PLK4 O00444 1/20 0.42
▸ DYRK3 O43781 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42
▸ ROS1 P08922 1/20 0.42
▸ AKT2 P31751 1/20 0.42
▸ MATK P42679 1/20 0.42
▸ MAPKAPK2 P49137 1/20 0.42
▸ CLK2 P49760 1/20 0.42
▸ GSK3A P49840 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ RPS6KA3 P51812 1/20 0.42
▸ PLK1 P53350 1/20 0.42
▸ CSNK2A1 P68400 1/20 0.42
▸ CSNK1G2 P78368 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
SCHEMBL11426339 0.96 AURKB (0.52) AURKBAURKAPRKD3NR4A1CDC7
SCHEMBL11441473 0.93 AURKA (0.50) AURKBAURKANR4A1KCNMA1HSD17B10
SCHEMBL11440861 0.92 AURKB (0.52) AURKBAURKAPRKD3NR4A1CDC7
SCHEMBL11426487 0.88 AURKA (0.44) AURKBAURKAKCNMA1HSD17B10RAB9A
SCHEMBL11427880 0.87 AURKB (0.49) AURKBAURKAPRKD3NR4A1CDC7
SCHEMBL11433621 0.87 SNCA (0.45) AURKBAURKAPRKD3KCNMA1HSD17B10
SCHEMBL11427850 0.87 AURKA (0.43) AURKBAURKAPRKD3KCNMA1HSD17B10
SCHEMBL11423958 0.86 KCNMA1 (0.53) AURKBAURKAPRKD3CDC7EEF2K
SCHEMBL11425033 0.84 AURKB (0.47) AURKBAURKAPRKD3NR4A1CDC7
SCHEMBL11438690 0.84 TTR (0.43) AURKBAURKAKCNMA1HSD17B10RAB9A

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
US-4216165-A Amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 — — US disclosed
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