SCHEMBL7416075

SCHEMBL7416075

COc1ccc(S(=O)(=O)N(Cc2ccc(-c3cccnc3)cc2)S(C)(=O)=O)cc1OC

nearest known ligand 0.78

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 8/20 0.78
PDE4A P27815 7/20 0.78
PDE4B Q07343 7/20 0.78
PDE4C Q08493 7/20 0.78
ABCB1 P08183 1/20 0.54
ABCC1 P33527 1/20 0.54
CYP11B1 P15538 2/20 0.52
CYP11B2 P19099 1/20 0.47
SMPD1 P17405 1/20 0.46
MKNK1 Q9BUB5 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPK1 P28482 1/20 0.45
GAA P10253 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
ACLY P53396 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
SCHEMBL7418919 0.92 PDE4A (0.82) PDE4DPDE4APDE4BPDE4CABCB1
SCHEMBL7425188 0.88 PDE4A (1.00) PDE4DPDE4APDE4BPDE4CALDH1A1
SCHEMBL7424700 0.85 PDE4D (0.66) PDE4DPDE4APDE4BPDE4CABCB1
SCHEMBL7422958 0.83 PDE4A (0.69) PDE4DPDE4APDE4BPDE4CABCB1
SCHEMBL7416808 0.80 PDE4D (0.73) PDE4DPDE4APDE4BPDE4CMAPK1
SCHEMBL7420807 0.79 PDE4D (0.65) PDE4DPDE4APDE4BPDE4CALDH1A1
SCHEMBL7425474 0.77 PDE4A (0.68) PDE4DPDE4APDE4BPDE4CMAPK1
SCHEMBL7419413 0.76 PDE4A (0.93) PDE4DPDE4APDE4BPDE4CALDH1A1
SCHEMBL7420702 0.76 PDE4A (1.00) PDE4DPDE4APDE4BPDE4CALDH1A1
SCHEMBL7418296 0.74 PDE4A (0.74) PDE4DPDE4APDE4BPDE4CABCB1

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