SCHEMBL7423955

SCHEMBL7423955

COc1ccc(S(=O)(=O)N(Cc2ccccc2)Cc2cccc(OS(C)(=O)=O)c2)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.63
PDE4B Q07343 3/20 0.63
PDE4C Q08493 3/20 0.63
PDE4D Q08499 3/20 0.63
TAS2R14 Q9NYV8 11/20 0.60
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
PTGES O14684 1/20 0.47
TAS2R8 Q9NYW2 1/20 0.47
CXCR3 P49682 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47
CA9 Q16790 1/20 0.47

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
SCHEMBL7424851 0.91 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7417394 0.87 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7423414 0.83 PDE4A (0.67) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7428277 0.83 TAS2R14 (0.67) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7422201 0.81 PDE4A (0.67) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7420151 0.81 TAS2R14 (0.78) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7418318 0.80 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7422978 0.80 TAS2R14 (0.69) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7425269 0.80 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DTAS2R14
SCHEMBL7413611 0.79 TAS2R14 (0.68) 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