SCHEMBL7422229

SCHEMBL7422229

COc1ccc(S(=O)(=O)N(Cc2ccccc2)Cc2ccc(C(=O)O)cc2)cc1OC

nearest known ligand 0.89

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 17/20 0.89
PTGES O14684 1/20 0.72
TAS2R8 Q9NYW2 1/20 0.72
CXCR3 P49682 1/20 0.72
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
PDE4A P27815 2/20 0.67
PDE4B Q07343 2/20 0.67
PDE4C Q08493 2/20 0.67
PDE4D Q08499 2/20 0.67

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
SCHEMBL1279106 0.94 TAS2R14 (1.00) TAS2R14PTGESTAS2R8CXCR3MEN1
SCHEMBL7420151 0.91 TAS2R14 (0.78) TAS2R14PTGESTAS2R8CXCR3MEN1
SCHEMBL7416090 0.91 TAS2R14 (0.74) TAS2R14PTGESTAS2R8CXCR3PDE4A
SCHEMBL7417394 0.90 PDE4A (0.79) TAS2R14PTGESTAS2R8CXCR3PDE4A
SCHEMBL7418883 0.88 PDE4A (0.78) TAS2R14PTGESTAS2R8CXCR3MEN1
SCHEMBL7422978 0.88 TAS2R14 (0.69) TAS2R14PTGESTAS2R8CXCR3PDE4A
SCHEMBL1279785 0.87 TAS2R14 (1.00) TAS2R14PTGESTAS2R8CXCR3MEN1
SCHEMBL1279152 0.86 TAS2R14 (1.00) TAS2R14PTGESTAS2R8CXCR3
SCHEMBL7418318 0.85 PDE4A (0.69) TAS2R14PTGESTAS2R8CXCR3MEN1
SCHEMBL7413611 0.84 TAS2R14 (0.68) TAS2R14PTGESTAS2R8CXCR3PDE4A

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-1996036595-A1 3,4-DISUBSTITUTED-PHENYLSULPHONAMIDES AND THEIR THERAPEUTIC USE CHIROSCIENCE LIMITED (GB) 1996-11-21 WO claimed
WO-1996036595-A1 3,4-DISUBSTITUTED-PHENYLSULPHONAMIDES AND THEIR THERAPEUTIC USE CHIROSCIENCE LIMITED (GB) 1996-11-21 WO disclosed