SCHEMBL7418919

SCHEMBL7418919

COc1ccc(S(=O)(=O)N(Cc2cccc(-c3cccnc3)c2)S(C)(=O)=O)cc1OC

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.82
PDE4B Q07343 7/20 0.82
PDE4C Q08493 7/20 0.82
PDE4D Q08499 7/20 0.82
ABCB1 P08183 1/20 0.52
ABCC1 P33527 1/20 0.52
CYP11B1 P15538 2/20 0.49
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47
GAA P10253 1/20 0.47
CYP11B2 P19099 1/20 0.45
NAMPT P43490 1/20 0.45
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
KDR P35968 1/20 0.44
PKM P14618 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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 0.92 PDE4D (0.78) PDE4APDE4BPDE4CPDE4DABCB1
SCHEMBL7425188 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7422958 0.83 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DABCB1
SCHEMBL7416808 0.80 PDE4D (0.73) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL7425093 0.80 PKM (0.66) PDE4APDE4BPDE4CPDE4DABCB1
SCHEMBL7419413 0.78 PDE4A (0.93) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7418296 0.77 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DABCB1
SCHEMBL7425474 0.77 PDE4A (0.68) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL7424700 0.76 PDE4D (0.66) PDE4APDE4BPDE4CPDE4DABCB1
SCHEMBL7421412 0.76 PDE4A (0.80) 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 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