Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL5674252

Cc1ccc[n+](Cc2ccccc2)c1.O=S(=O)([O-])C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
PABPC1 P11940 1/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
RAB9A P51151 1/20 0.41
GGPS1 O95749 1/20 0.41
KCNH2 Q12809 2/20 0.38

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 SCHEMBL5672510 0.85 LMNA (0.46) LMNAL3MBTL1KMT2ANPSR1KDM4E
SCHEMBL30192808 0.84 LMNA (0.61) LMNAL3MBTL1PABPC1KMT2AATM
SCHEMBL5286396 0.84 LMNA (0.61) LMNAL3MBTL1PABPC1KMT2AATM
Hydrochloric Acid SCHEMBL5155050 0.83 LMNA (0.65) LMNAL3MBTL1PABPC1KMT2AATM
Bromide SCHEMBL17105097 0.83 LMNA (0.62) LMNAL3MBTL1PABPC1KMT2AATM
SCHEMBL5074160 0.82 LMNA (0.55) LMNAL3MBTL1PABPC1KMT2AATM
Trifluoromethanesulfonic Acid SCHEMBL3629145 0.82 KCNH2 (0.44) LMNAL3MBTL1PABPC1KMT2AATM
Trifluoromethanesulfonic Acid SCHEMBL5674195 0.81 L3MBTL1 (0.56) LMNAL3MBTL1PABPC1KMT2AATM
Trifluoromethanesulfonic Acid SCHEMBL6516307 0.81 KCNH2 (0.40) LMNAL3MBTL1PABPC1KMT2AATM
Trifluoromethanesulfonic Acid SCHEMBL5671407 0.80 LMNA (0.43) LMNAL3MBTL1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373552-A4 NOVEL AGENTS FOR REPLACEMENT OF NAD+/NADH SYSTEM IN ENZYMATIC RACTIONS UNIV CALIFORNIA (US) 2006-06-28 EP disclosed
US-20040235084-A1 Novel agents for replacement of NAD+/NADH system in enzymatic reactions ENERGY, UNITED STATES DEPARTMENT OF 2004-11-25 US disclosed
US-6716596-B2 biomimic cofactor; 3-substituted pyridium compounds; nicotinamides N-substituted with benzyl or polyoxyethylene glycol derivatives; bipyridyl rhodium hydride complex catalyst for reduction of the cofactor; polymer matrix; economical in large scale; biosensor or a chemical membrane bioreactor THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-04-06 US disclosed
EP-1373552-A2 NOVEL AGENTS FOR REPLACEMENT OF NAD+/NADH SYSTEM IN ENZYMATIC RACTIONS The Regents of the University of California (US) 2004-01-02 EP disclosed
US-20030022266-A1 Novel agents for replacement of NAD+/NADH system in enzymatic reactions ENERGY, U.S. DEPARTMENT OF 2003-01-30 US disclosed
WO-2002072869-A2 NOVEL AGENTS FOR REPLACEMENT OF NAD+/NADH SYSTEM IN ENZYMATIC RACTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2002-09-19 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-20030022266-A1 Novel agents for replacement of NAD+/NADH system in enzymatic reactions NQO1, NADK, ME2 LMNA 3814/4885L3MBTL1 4651/4885PABPC1 3978/4885
US-20040235084-A1 Novel agents for replacement of NAD+/NADH system in enzymatic reactions NQO1, NADK, ME2 LMNA 3814/4885L3MBTL1 4651/4885PABPC1 3978/4885

“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.