Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL9686740

Cc1cccc(C)[n+]1F.O=S(=O)([O-])C(F)(F)F

nearest known ligand 0.44

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Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 13/20 0.44
ACHE P22303 5/20 0.44
GPR3 P46089 2/20 0.43

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
Trifluoromethanesulfonic Acid SCHEMBL6432764 0.84 KCNH2 (0.51) KCNH2ACHEGPR3
Trifluoromethanesulfonic Acid SCHEMBL64156 0.80 GPR3 (0.41) KCNH2ACHEGPR3
Trifluoromethanesulfonic Acid SCHEMBL10398842 0.79 ACHE (0.48) KCNH2ACHEGPR3
SCHEMBL17286589 0.78
Trifluoromethanesulfonic Acid SCHEMBL63721 0.76 GPR3 (0.43) KCNH2ACHEGPR3
Trifluoromethanesulfonic Acid SCHEMBL9066395 0.76 KCNH2 (0.55) KCNH2ACHEGPR3
Trifluoromethanesulfonic Acid SCHEMBL6421880 0.76 GPR3 (0.43) KCNH2ACHEGPR3
Trifluoromethanesulfonic Acid SCHEMBL30330386 0.76 GPR3 (0.43) KCNH2ACHEGPR3
Trifluoromethanesulfonic Acid SCHEMBL29114404 0.74 GPR3 (0.42) KCNH2ACHEGPR3
Trifluoromethanesulfonic Acid SCHEMBL5948989 0.72 KCNH2 (0.51) KCNH2ACHEGPR3

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
EP-0204535-B1 N-FLUOROPYRIDINIUM SALT AND PROCESS FOR PREPARING SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-08-19 EP disclosed
US-4996320-A Thyroid inhibitors SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-02-26 US disclosed
EP-0204535-A1 N-fluoropyridinium salt and process for preparing same SAGAMI CHEMICAL RESEARCH CENTER (JP) 1986-12-10 EP disclosed