SCHEMBL7414911

SCHEMBL7414911

COc1ccc(S(=O)(=O)N(Cc2cccnc2)S(=O)(=O)CCNCc2ccccc2)cc1OC

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.78
PDE4B Q07343 7/20 0.78
PDE4C Q08493 7/20 0.78
PDE4D Q08499 7/20 0.78
NAMPT P43490 2/20 0.49
GAA P10253 1/20 0.49
LMNA P02545 1/20 0.46
PKM P14618 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 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
SCHEMBL7598376 0.88 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7420221 0.85 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7423718 0.85 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7424242 0.85 PDE4A (0.72) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7418296 0.84 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7422581 0.83 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7425188 0.81 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7420778 0.80 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7420702 0.80 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DNAMPT
SCHEMBL7421101 0.79 PDE4A (0.83) PDE4APDE4BPDE4CPDE4DNAMPT

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