SCHEMBL7360976

SCHEMBL7360976

COc1ccc(S(=O)(=O)N2C(c3ccccc3)=Cc3ccccc3C2O)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PDE4A P27815 6/20 0.44
PDE4B Q07343 6/20 0.44
PDE4C Q08493 6/20 0.44
PDE4D Q08499 6/20 0.44
CTSG P08311 1/20 0.42
CMA1 P23946 1/20 0.42
TSHR P16473 3/20 0.41
MAPK1 P28482 2/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
GPBAR1 Q8TDU6 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
GLA P06280 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL7359732 0.76 GPBAR1 (0.43) KDM4EALDH1A1MAPTTDP1PDE4A
SCHEMBL7362708 0.72 KDM4E (0.47) KDM4EALDH1A1MAPTTDP1PDE4A
SCHEMBL8603220 0.68 KDM4E (0.46) KDM4EALDH1A1MAPTTDP1PDE4A
SCHEMBL5214099 0.68 PDE4A (0.49) KDM4EALDH1A1MAPTTDP1PDE4A
SCHEMBL7366204 0.67 KDM4E (0.45) KDM4EALDH1A1MAPTTDP1PDE4A
SCHEMBL3757147 0.65 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL16797504 0.63 MAPK1 (0.81) KDM4EALDH1A1MAPTTDP1TSHR
SCHEMBL4169902 0.63 GPBAR1 (0.69) KDM4EALDH1A1MAPTTSHRMAPK1
SCHEMBL7362713 0.63 PDE4A (0.63) KDM4EALDH1A1MAPTTDP1PDE4A
SCHEMBL27996488 0.63 MAPK1 (0.68) ALDH1A1MAPTPDE4APDE4BPDE4C

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5728712-A 3,4-disubstituted-phenylsulphonamides and their therapeutic use CHIROSCIENCE LIMITED (GB) 1998-03-17 US claimed
US-5728712-A 3,4-disubstituted-phenylsulphonamides and their therapeutic use CHIROSCIENCE LIMITED (GB) 1998-03-17 US disclosed
WO-1996036611-A1 3,4-DISUBSTITUTED-PHENYLSULPHONAMIDES AND THEIR THERAPEUTIC USE CHIROSCIENCE LIMITED (GB) 1996-11-21 WO disclosed