SCHEMBL14308049

SCHEMBL14308049

Cc1ccc([S+]([O-])C(C)(C)C(=O)Nc2cccc(C(F)(F)F)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CLK4 Q9HAZ1 8/20 0.45
▸ ACVR1 Q04771 7/20 0.45
▸ HIPK4 Q8NE63 5/20 0.45
▸ STK3 Q13188 4/20 0.45
▸ AURKB Q96GD4 4/20 0.45
▸ FLT3 P36888 3/20 0.45
▸ CSNK2A1 P68400 3/20 0.45
▸ PRKD3 O94806 3/20 0.45
▸ PBK Q96KB5 3/20 0.45
▸ CDK1 P06493 3/20 0.45
▸ CDK2 P24941 3/20 0.45
▸ CDK5 Q00535 3/20 0.45
▸ PIM3 Q86V86 3/20 0.45
▸ HIPK2 Q9H2X6 3/20 0.45
▸ CDK8 P49336 3/20 0.45
▸ FLT4 P35916 2/20 0.45
▸ FRK P42685 2/20 0.45
▸ MST1R Q04912 2/20 0.45
▸ PTK6 Q13882 2/20 0.45
▸ MINK1 Q8N4C8 2/20 0.45

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
SCHEMBL14319140 0.91 GRM5 (0.48) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL14309232 0.84 CLK4 (0.41) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL14319138 0.81 HCRTR1 (0.41) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL12102188 0.79 ACVR1 (0.47) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL1464304 0.79 CNR2 (0.50) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL13842703 0.78 RORC (0.48) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL1464316 0.76 GSK3A (0.49) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL14960342 0.74 GSK3A (0.48) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL2635287 0.72 TAS2R14 (0.57) CLK4ACVR1HIPK4STK3AURKB
SCHEMBL13842719 0.72 HTR1A (0.41) CLK4ACVR1HIPK4STK3AURKB

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-2008014199-A2 SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-01-31 — — WO disclosed
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