Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL2356860

CC(C)(C)OC(=O)NC(=N)NC(=O)OC(C)(C)C.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 8/20 0.36
CA1 P00915 8/20 0.36
CA2 P00918 7/20 0.36
CA14 Q9ULX7 4/20 0.36
CA7 P43166 3/20 0.36
TDP1 Q9NUW8 1/20 0.35
APLNR P35414 1/20 0.33
CA9 Q16790 4/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
DGAT1 O75907 1/20 0.31
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 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
SCHEMBL604019 0.84 TDP1 (0.39) CA12CA1CA2CA14CA7
SCHEMBL2213809 0.83 CA12 (0.37) CA12CA1CA2CA14CA7
Guanidine SCHEMBL18128882 0.79 MAOA (0.39) CA12CA1CA2CA14CA7
Acetic Acid SCHEMBL3489390 0.79 MEN1 (0.38) CA12CA1CA2CA14CA7
SCHEMBL15553702 0.77 MEN1 (0.37) CA12CA1CA2CA14CA7
SCHEMBL15305058 0.76 TDP1 (0.34) CA12CA1CA2CA14CA7
SCHEMBL10819634 0.76 TDP1 (0.34) CA12CA1CA2CA14CA7
SCHEMBL8233731 0.75 TDP1 (0.36) CA12CA1CA2CA14CA7
SCHEMBL5574662 0.74 CA14 (0.34) CA12CA1CA2CA14CA7
SCHEMBL15279713 0.73 APLNR (0.43) CA1CA2CA7TDP1APLNR

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
US-20110319366-A1 Plasma Carboxypeptidase B Inhibitors BUCKMAN BRAD (US) 2011-12-29 US disclosed
US-8008325-B2 Plasma carboxypeptidase B inhibitors BAYER SCHERING PHARMA AG (DE) 2011-08-30 US disclosed
EP-2204373-A1 Phosphonic acid as Plasma Carboxypeptidase B Inhibitors Bayer Schering Pharma Aktiengesellschaft (DE) 2010-07-07 EP disclosed
US-7528173-B2 Plasma carboxypeptidase B inhibitors SCHERING AKTIENGESELLSHAFT (DE) 2009-05-05 US disclosed
US-20090093520-A1 PLASMA CARBOXYPEPTIDASE B INHIBITORS BUCKMAN BRAD 2009-04-09 US disclosed
US-20060247213-A1 Plasma carboxypeptidase b inhibitors SCHERING AKTIENGESELLSCHAFT (DE) 2006-11-02 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 (3 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-20110319366-A1 Plasma Carboxypeptidase B Inhibitors CPB1, CPB2, CPA1 CA12 523/4885CA1 441/4885CA2 288/4885
US-20090093520-A1 PLASMA CARBOXYPEPTIDASE B INHIBITORS CPB1, CPB2, CPA1 CA12 523/4885CA1 441/4885CA2 288/4885
US-20060247213-A1 Plasma carboxypeptidase b inhibitors CPB1, CPB2, CPA1 CA12 585/4885CA1 379/4885CA2 322/4885

“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.