Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL3519717

O=S(=O)([O-])C(F)(F)F.S=c1c2ccccc2oc2c([S+](c3ccccc3)c3ccccc3)cccc12

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
GPR3 P46089 1/20 0.31
CDC14B O60729 3/20 0.31
CDC14A Q9UNH5 3/20 0.31
ALDH1A1 P00352 1/20 0.30
PPARG P37231 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
NR2E3 Q9Y5X4 1/20 0.30
NCOR2 Q9Y618 1/20 0.30

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
SCHEMBL3524443 0.89
Trifluoromethanesulfonic Acid SCHEMBL3520068 0.87 MAOA (0.48) MAOAALDH1A1RXFP1
SCHEMBL3523127 0.84 RXFP1 (0.36) ALDH1A1PPARGRXFP1NR2E3NCOR2
SCHEMBL3522339 0.81 MEN1 (0.31) MAOAALDH1A1PPARGRXFP1NR2E3
Trifluoromethanesulfonic Acid SCHEMBL3521317 0.81 SMN1; SMN2 (0.34) MAOAGPR3CDC14BCDC14AALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL3520616 0.78 CYP2A6 (0.37) GPR3ALDH1A1
SCHEMBL3517033 0.77 MAOA (0.40) MAOAALDH1A1RXFP1
Trifluoromethanesulfonic Acid SCHEMBL547976 0.75 GPR3 (0.38) GPR3ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL29402880 0.75 GPR3 (0.38) GPR3ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL3519028 0.74 BCAT1 (0.38) GPR3ALDH1A1PPARGRXFP1NR2E3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7833691-B2 Heterocycle-bearing onium salts WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2010-11-16 US disclosed
EP-1953149-A2 A heterocycle-containing onium salt Wako Pure Chemical Industries, Ltd. (JP) 2008-08-06 EP disclosed
US-20080161520-A1 Heterocycle-bearing onium salts WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2008-07-03 US disclosed
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

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

For each of this compound's patents that has machine-readable text (2 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 MAOA 1663/4885GPR3 1487/4885CDC14B 4372/4885
US-20080161520-A1 Heterocycle-bearing onium salts MCM5, NIT2, PCNA MAOA 1429/4885GPR3 4198/4885CDC14B 769/4885

“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.