SCHEMBL7418683

SCHEMBL7418683

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

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.80
PDE4B Q07343 4/20 0.80
PDE4C Q08493 4/20 0.80
PDE4D Q08499 4/20 0.80
TAS2R14 Q9NYV8 5/20 0.59
LMNA P02545 1/20 0.56
TP53 P04637 2/20 0.55
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
HIF1A Q16665 2/20 0.52
EPAS1 Q99814 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPT P10636 2/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL7418883 0.90 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7416090 0.88 TAS2R14 (0.74) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7418172 0.81 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7420943 0.81 PDE4A (0.62) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7206100 0.80 L3MBTL1 (0.76) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7421609 0.79 PDE4D (0.63) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7413611 0.79 TAS2R14 (0.68) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL11877545 0.79 CA9 (0.69) ALDH1A1KDM4EL3MBTL1MAPTMEN1
SCHEMBL7422229 0.78 TAS2R14 (0.89) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7424700 0.76 PDE4D (0.66) 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 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