Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL1603358

O=C(CCCCCCCCCC[n+]1c2ccccc2c(C(=O)Oc2c([N+](=O)[O-])cccc2[N+](=O)[O-])c2ccccc21)ON1C(=O)CCC1=O.O=S(=O)([O-])C(F)(F)F

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
Trifluoromethanesulfonic Acid SCHEMBL1603139 0.97 CA12 (0.31) CA12CA1CA2CA9
SCHEMBL4379714 0.93 CA12 (0.30) CA12CA1CA2CA9
SCHEMBL4374679 0.90 CA12 (0.31) CA12CA1CA2CA9
Trifluoromethanesulfonic Acid SCHEMBL1603406 0.89
Trifluoromethanesulfonic Acid SCHEMBL1603217 0.89
Trifluoromethanesulfonic Acid SCHEMBL1602667 0.85
Trifluoromethanesulfonic Acid SCHEMBL1603301 0.85
SCHEMBL4377347 0.82
SCHEMBL4385123 0.80 PSMB8 (0.31)
SCHEMBL4382791 0.79 ELANE (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110082279-A1 Chemiluminescent Compounds GEN-PROBE INCORPORATED (US) 2011-04-07 US claimed
EP-1658503-B1 CHEMILUMINESCENT COMPOUNDS MOLECULAR LIGHT TECH RES LTD (GB) 2009-11-18 EP claimed
US-20070166759-A1 Chemiluminescent compounds GEN-PROBE CARDIFF, LTD. (GB) 2007-07-19 US claimed
EP-1658503-A1 CHEMILUMINESCENT COMPOUNDS Molecular Light Technology Research Limited (GB) 2006-05-24 EP claimed
WO-2005022161-A1 CHEMILUMINESCENT COMPOUNDS MOLECULAR LIGHT TECHNOLOGY RESEARCH LIMITED (GB) 2005-03-10 WO claimed
US-20110082279-A1 Chemiluminescent Compounds GEN-PROBE INCORPORATED (US) 2011-04-07 US disclosed
EP-1658503-B1 CHEMILUMINESCENT COMPOUNDS MOLECULAR LIGHT TECH RES LTD (GB) 2009-11-18 EP disclosed
US-20070166759-A1 Chemiluminescent compounds GEN-PROBE CARDIFF, LTD. (GB) 2007-07-19 US disclosed
US-20070077639-A1 Estimation of activity or inhibition of processes involved in nucleic acid modification using chemiluminescence quenching WEEKS IAN 2007-04-05 US disclosed
EP-1658503-A1 CHEMILUMINESCENT COMPOUNDS Molecular Light Technology Research Limited (GB) 2006-05-24 EP disclosed
EP-1658381-A2 ESTIMATION OF ACTIVITY OR INHIBITION OF PROCESSES INVOLVED IN NUCLEIC ACID MODIFICATION USING CHEMILUMINESCENCE QUENCHING Molecular Light Technology Research Limited (GB) 2006-05-24 EP disclosed
WO-2005021784-A2 ESTIMATION OF ACTIVITY OR INHIBITION OF PROCESSES INVOLVED IN NUCLEIC ACID MODIFICATION USING CHEMILUMINESCENCE QUENCHING MOLECULAR LIGHT TECHNOLOGY RESEARCH LIMITED (GB) 2005-03-10 WO disclosed
WO-2005022161-A1 CHEMILUMINESCENT COMPOUNDS MOLECULAR LIGHT TECHNOLOGY RESEARCH LIMITED (GB) 2005-03-10 WO 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-20070166759-A1 Chemiluminescent compounds CBR3, CBR1, LTC4S CA12 648/4885CA1 896/4885CA2 541/4885
US-20110082279-A1 Chemiluminescent Compounds CBR3, LTC4S, CBR1 CA12 740/4885CA1 949/4885CA2 626/4885

“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.