Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL406607

CC(C)(C)OC(=O)N1CC[C@H]1COc1ccc([S+](c2ccccc2)c2ccccc2)nc1.O=S(=O)([O-])C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.38
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35

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
SCHEMBL406608 0.79 NR1H2 (0.40) GPR119ALOX5APFEN1NR1H2NR1H3
SCHEMBL7479360 0.77 CHRNB2 (0.46) GPR119ALOX5APFEN1
SCHEMBL7407720 0.76 CHRNB2 (0.53) GPR119ALOX5APFEN1
SCHEMBL18291358 0.75 ALOX5AP (0.50) GPR119ALOX5APFEN1
SCHEMBL6588716 0.75 CHRNA3 (0.59) GPR119ALOX5APFEN1
SCHEMBL7472876 0.75 CHRNA3 (0.59) GPR119ALOX5APFEN1
SCHEMBL7472930 0.75 CHRNB2 (0.54) GPR119ALOX5APFEN1
SCHEMBL7481577 0.75 ALOX5AP (0.44) GPR119ALOX5APFEN1
SCHEMBL7408557 0.74 GPR119 (0.48) GPR119ALOX5APFEN1
SCHEMBL7455050 0.74 GPR119 (0.42) GPR119ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120020881-A1 Triaryl-sulphonium compounds, kit and methods for labeling positron emitting isotopes BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-26 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 (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-20120020881-A1 Triaryl-sulphonium compounds, kit and methods for labeling positron emitting isotopes KIT, STS, TST GPR119 1201/4885ALOX5AP 4448/4885FEN1 3721/4885

“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.