SCHEMBL7598376

SCHEMBL7598376

COc1ccc(S(=O)(=O)N(Cc2cccnc2)S(=O)(=O)CCNS(=O)(=O)c2ccccc2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 1.00
PDE4B Q07343 7/20 1.00
PDE4C Q08493 7/20 1.00
PDE4D Q08499 7/20 1.00
HTT P42858 2/20 0.50
PKM P14618 1/20 0.50
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NAMPT P43490 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL7421101 0.91 PDE4A (0.83) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL7414911 0.88 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL7423718 0.87 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DPKM
SCHEMBL7420221 0.85 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL7424242 0.84 PDE4A (0.72) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL7418296 0.83 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DPKM
SCHEMBL7422581 0.82 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL7425188 0.80 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPKM
SCHEMBL7415562 0.79 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL7420778 0.79 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DGAA

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 disclosed