SCHEMBL9225293

SCHEMBL9225293

CCCCCCCN(CC)CC/C=C/c1cccc(NS(C)(=O)=O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.50
CACNA1F O60840 1/20 0.50
CHRM2 P08172 1/20 0.50
ADRA2B P18089 1/20 0.50
ADRA2C P18825 1/20 0.50
CHRM3 P20309 1/20 0.50
HTR2A P28223 1/20 0.50
SLC6A4 P31645 1/20 0.50
DRD3 P35462 1/20 0.50
CACNA1D Q01668 1/20 0.50
CACNA1S Q13698 1/20 0.50
CACNA1C Q13936 1/20 0.50
NR3C1 P04150 2/20 0.40
PGR P06401 1/20 0.40
NR3C2 P08235 1/20 0.40
AR P10275 1/20 0.40
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL9225311 1.00 KCNH2 (0.50) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9224452 0.86 KCNH2 (0.60) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9224440 0.86 KCNH2 (0.60) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9226352 0.86 KCNH2 (0.60) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9226364 0.86 KCNH2 (0.60) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9624200 0.78 KCNH2 (0.57) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9626240 0.78 KCNH2 (0.55) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9226517 0.77 KCNH2 (0.46) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9226525 0.77 KCNH2 (0.46) KCNH2CACNA1FCHRM2ADRA2BADRA2C
SCHEMBL9226308 0.76 KCNH2 (0.79) KCNH2CACNA1FCHRM2ADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0484378-B1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES UPJOHN CO (US) 1994-09-14 EP claimed
EP-0484378-A1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES. UPJOHN CO (US) 1992-05-13 EP claimed
WO-1991001299-A1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES THE UPJOHN COMPANY (US) 1991-02-07 WO claimed
US-5405997-A Stable against rapid metabolism THE UPJOHN COMPANY (US) 1995-04-11 US disclosed
EP-0484378-B1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES UPJOHN CO (US) 1994-09-14 EP disclosed
EP-0484378-A1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES. UPJOHN CO (US) 1992-05-13 EP disclosed
WO-1991001299-A1 ANTIARRHYTHMIC TERTIARY AMINE-ALKENYL-PHENYL-ALKANESULFONAMIDES THE UPJOHN COMPANY (US) 1991-02-07 WO disclosed