SCHEMBL7418883

SCHEMBL7418883

CCCN(Cc1ccc(C(=O)O)cc1)S(=O)(=O)c1ccc(OC)c(OC)c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.78
PDE4B Q07343 2/20 0.78
PDE4C Q08493 2/20 0.78
PDE4D Q08499 2/20 0.78
TAS2R14 Q9NYV8 14/20 0.73
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
CA12 O43570 1/20 0.59
CA2 P00918 1/20 0.59
RAB9A P51151 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CA9 Q16790 1/20 0.59
SLC22A6 Q4U2R8 1/20 0.59
SLC22A8 Q8TCC7 1/20 0.59
ABCC2 Q92887 1/20 0.59
SLC22A12 Q96S37 1/20 0.59
UGT1A7 Q9HAW7 1/20 0.59
SLC22A11 Q9NSA0 1/20 0.59
PTGES O14684 1/20 0.57
TAS2R8 Q9NYW2 1/20 0.57

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
SCHEMBL7418683 0.90 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7422229 0.88 TAS2R14 (0.89) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL1279042 0.85 TAS2R14 (1.00) TAS2R14CA12CA2RAB9ASMN1; SMN2
SCHEMBL1279106 0.83 TAS2R14 (1.00) TAS2R14MEN1KMT2APTGESTAS2R8
SCHEMBL1279152 0.82 TAS2R14 (1.00) TAS2R14PTGESTAS2R8CXCR3
SCHEMBL7206100 0.81 L3MBTL1 (0.76) PDE4APDE4BPDE4CPDE4DCA12
SCHEMBL7421609 0.80 PDE4D (0.63) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7418172 0.80 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7416090 0.80 TAS2R14 (0.74) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7420151 0.80 TAS2R14 (0.78) PDE4APDE4BPDE4CPDE4DTAS2R14

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