SCHEMBL7418296

SCHEMBL7418296

COc1ccc(S(=O)(=O)N(Cc2cccnc2)S(=O)(=O)CCN)cc1OC

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.74
PDE4B Q07343 7/20 0.74
PDE4C Q08493 7/20 0.74
PDE4D Q08499 7/20 0.74
ALDH1A1 P00352 1/20 0.49
MAPK1 P28482 1/20 0.49
GAA P10253 1/20 0.49
NAMPT P43490 1/20 0.47
PKM P14618 1/20 0.46
RAB9A P51151 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ABCB1 P08183 1/20 0.45
ABCC1 P33527 1/20 0.45
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL7423718 0.87 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7425488 0.87 PDE4D (0.58) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7424242 0.86 PDE4A (0.72) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7425188 0.85 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7414911 0.84 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7598376 0.83 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7419413 0.83 PDE4A (0.93) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7420778 0.83 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7422581 0.82 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7420221 0.81 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DALDH1A1

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