Trifluoromethanesulfonamide

Trifluoromethanesulfonamide

SCHEMBL2295366

CCCC[n+]1ccccc1.NS(=O)(=O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.53
CHRM2 P08172 2/20 0.53
ADRA2A P08913 2/20 0.53
ADORA3 P0DMS8 2/20 0.53
CHRM1 P11229 2/20 0.53
SLC6A2 P23975 2/20 0.53
SLC6A4 P31645 2/20 0.53
SLC6A3 Q01959 2/20 0.53
ABCB11 O95342 1/20 0.53
ESR1 P03372 1/20 0.53
PGR P06401 1/20 0.53
HTR1A P08908 1/20 0.53
DRD1 P21728 1/20 0.53
TBXA2R P21731 1/20 0.53
PTGS1 P23219 1/20 0.53
PDE4A P27815 1/20 0.53
ADRA1A P35348 1/20 0.53
OPRM1 P35372 1/20 0.53
DRD3 P35462 1/20 0.53
KCNH2 Q12809 1/20 0.53

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
Trifluoromethanesulfonamide SCHEMBL2118135 0.93 ACHE (0.65) ACHECHRM2ADRA2AADORA3CHRM1
Trifluoromethanesulfonic Acid SCHEMBL609162 0.86 KCNH2 (0.53) ACHECHRM2ADRA2AADORA3CHRM1
Trifluoromethanesulfonic Acid SCHEMBL27642997 0.86 ACHE (0.53) ACHECHRM2ADRA2AADORA3CHRM1
SCHEMBL303159 0.83 ACHE (0.50) ACHECHRM2ADRA2AADORA3CHRM1
SCHEMBL1358752 0.83 ACHE (0.50) ACHECHRM2ADRA2AADORA3CHRM1
SCHEMBL28402165 0.82 ACHE (0.49) ACHECHRM2ADRA2AADORA3CHRM1
SCHEMBL16036661 0.82 KCNH2 (0.49) ACHECHRM2ADRA2AADORA3CHRM1
Hydrochloric Acid SCHEMBL31010993 0.82 KMT2A (0.51) ACHECHRM2ADRA2AADORA3CHRM1
Trifluoromethanesulfonamide SCHEMBL2121212 0.82 LMNA (0.43) KCNH2RAD52KMT2ASMN1; SMN2HSP90AA1
Trifluoromethanesulfonic Acid SCHEMBL16699863 0.81 KCNH2 (0.61) ACHECHRM2ADRA2AADORA3CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1674444-B9 METHOD FOR PRODUCING ESTER CONDENSED PRODUCT JAPAN SCIENCE & TECH AGENCY (JP) 2013-11-20 EP disclosed
EP-1674444-B1 METHOD FOR PRODUCING ESTER CONDENSED PRODUCT JAPAN SCIENCE & TECH AGENCY (JP) 2013-07-17 EP disclosed
US-7973193-B2 Method for producing ester condensed product JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-07-05 US disclosed
US-20090187042-A1 METHOD FOR PRODUCING ESTER CONDENSED PRODUCT JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-07-23 US disclosed
US-20070004936-A1 Method for producing ester condensed product JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2007-01-04 US disclosed
EP-1674444-A1 METHOD FOR PRODUCING ESTER CONDENSED PRODUCT Japan Science and Technology Agency (JP) 2006-06-28 EP disclosed