SCHEMBL7419475

SCHEMBL7419475

COc1ccc(S(=O)(=O)N(CCCC#N)CCc2ccccn2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.59
PDE4B Q07343 10/20 0.59
PDE4C Q08493 10/20 0.59
PDE4D Q08499 10/20 0.59
LMNA P02545 1/20 0.51
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 4/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TDP1 Q9NUW8 1/20 0.46
MAPK1 P28482 1/20 0.43
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
ACHE P22303 1/20 0.42

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
SCHEMBL7415074 0.91 PDE4A (0.68) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7424640 0.85 PDE4D (0.64) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7423813 0.79 PDE4D (0.61) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7418387 0.78 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7429183 0.77 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7204752 0.75 PDE4D (0.61) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7423605 0.75 PDE4A (0.67) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7417324 0.74 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7424509 0.74 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7417933 0.73 PDE4A (0.62) PDE4APDE4BPDE4CPDE4DLMNA

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