Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL5114458

O=S(=O)(O)C(F)(F)F.O=c1ccc2ccc(S)cc2o1

nearest known ligand 0.50

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 5/20 0.50
GAA P10253 4/20 0.50
CA12 O43570 12/20 0.47
CA9 Q16790 12/20 0.47
CA1 P00915 8/20 0.47
KDM4E B2RXH2 6/20 0.47
MCL1 Q07820 5/20 0.47
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 4/20 0.47
AKR1B1 P15121 3/20 0.47
HPGD P15428 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
CASP1 P29466 2/20 0.47
CASP7 P55210 2/20 0.47
ERAP1 Q9NZ08 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 2/20 0.44
CYP3A4 P08684 2/20 0.44
ACHE P22303 2/20 0.44

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
SCHEMBL6875856 0.86 GLA (0.44) GLAGAACA12CA9CA1
SCHEMBL5040810 0.83 CA12 (0.59) GLAGAACA12CA9CA1
SCHEMBL6869582 0.83 GLA (0.43) GLAGAACA12CA9CA1
SCHEMBL6875324 0.83 GLA (0.43) GLAGAACA12CA9CA1
Bromide SCHEMBL6878726 0.82 CA12 (0.57) GLAGAACA12CA9CA1
SCHEMBL6869309 0.81 GLA (0.47) GLAGAACA12CA9CA1
Coumarin SCHEMBL15573960 0.80 CA12 (0.67) GLAGAACA12CA9CA1
Perchlorate SCHEMBL5046259 0.78 CA12 (0.53) GLAGAACA12CA9CA1
SCHEMBL6880909 0.77 CA12 (0.49) GLAGAACA12CA9CA1
SCHEMBL6869907 0.75 THRB (0.44) GLAGAACA12CA9CA1

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-7318991-B2 Diphenylsulfonium compounds in which the S atom is additionally attached to a xanthene-9-onyl-2-yl- or coumarin-7-yl- ring; acid generator for a chemically amplified resist; photopolymerization initiator for polymerizing an epoxide or a vinyl ether WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2008-01-15 US disclosed
US-20050233253-A1 Diphenylsulfonium compounds in which the S atom is additionally attached to a xanthene-9-onyl-2-yl- or coumarin-7-yl- ring; acid generator for a chemically amplified resist; photopolymerization initiator for polymerizing an epoxide or a vinyl ether WAKO PURE CHEMICAL INDUSTRIES, LTD (JP) 2005-10-20 US disclosed
EP-1481973-A1 HETEROCYCLE-BEARING ONIUM SALTS Wako Pure Chemical Industries, Ltd. (JP) 2004-12-01 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050233253-A1 Diphenylsulfonium compounds in which the S atom is additionally attached to a xanthene-9-onyl-2-yl- or coumarin-7-yl- ring; acid generator for a chemically amplified resist; photopolymerization initiator for polymerizing an epoxide or a vinyl ether NOX4, CBR1, CBR3 GLA 884/4885GAA 1801/4885CA12 3023/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.