SCHEMBL7422958

SCHEMBL7422958

COc1ccc(S(=O)(=O)N(Cc2ccccc2-c2cccnc2)S(C)(=O)=O)cc1OC

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.69
PDE4B Q07343 7/20 0.69
PDE4C Q08493 7/20 0.69
PDE4D Q08499 7/20 0.69
ABCB1 P08183 1/20 0.48
ABCC1 P33527 1/20 0.48
PTGS2 P35354 1/20 0.46
TP53 P04637 1/20 0.45
HPGD P15428 1/20 0.45
GAA P10253 1/20 0.43
RAB9A P51151 1/20 0.42
MKNK1 Q9BUB5 2/20 0.42
MKNK2 Q9HBH9 2/20 0.42
CYP11B1 P15538 1/20 0.41
NAMPT P43490 1/20 0.41

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
SCHEMBL7416075 0.83 PDE4D (0.78) PDE4APDE4BPDE4CPDE4DABCB1
SCHEMBL7418919 0.83 PDE4A (0.82) PDE4APDE4BPDE4CPDE4DABCB1
SCHEMBL7425188 0.82 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL7422391 0.79 MAPK1 (0.60) PDE4APDE4BPDE4CPDE4DABCB1
SCHEMBL7425474 0.75 PDE4A (0.68) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL7416808 0.74 PDE4D (0.73) PDE4APDE4BPDE4CPDE4D
SCHEMBL7420239 0.74 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL7419413 0.72 PDE4A (0.93) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL7420702 0.72 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL7424700 0.71 PDE4D (0.66) PDE4APDE4BPDE4CPDE4DABCB1

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