Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL630048

O=C(C(Cl)Cl)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
ALDH1A1 P00352 3/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
CA2 P00918 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL112469 0.91
Water SCHEMBL7929821 0.88 LMNA (0.37) LMNAALDH1A1CA2
Water SCHEMBL5127632 0.88 LMNA (0.37) LMNAALDH1A1CA2
Water SCHEMBL6763348 0.88 LMNA (0.37) LMNAALDH1A1CA2
Trifluoroacetic Acid SCHEMBL28287909 0.82 LMNA (0.62) LMNAALDH1A1TP53TSHRCA2
Trifluoroacetic Acid SCHEMBL18167021 0.82 ALDH1A1 (0.41) LMNAALDH1A1TP53TSHRCA2
Trifluoroacetic Acid SCHEMBL269102 0.82 ALDH1A1 (0.41) LMNAALDH1A1TP53TSHRCA2
Trifluoroacetic Acid SCHEMBL28012644 0.79 ALDH1A1 (0.39) LMNAALDH1A1TP53TSHRCA2
Trifluoroacetic Acid SCHEMBL9003919 0.77 ALDH1A1 (0.37) LMNAALDH1A1TP53TSHRCA2
Trifluoroacetic Acid SCHEMBL3055318 0.77 ALDH1A1 (0.38) LMNAALDH1A1TP53TSHRCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1534680-B1 PRENYLATION INHIBITORS AND METHODS OF THEIR SYNTHESIS AND USE PHARMACO INVESTMENTS INC (US) 2012-02-22 EP disclosed
US-20110200528-A1 CYCLIZED NGR PEPTIDE COMPOUNDS, COMPOSITIONS, AND METHODS OF THEIR USE THE GOVERNMENT OF THE UNITED STATES OF AMERICA 2011-08-18 US disclosed
EP-1833978-B1 TRIPEPTIDE AND TETRAPEPTIDE THIOETHERS TELIK INC (US) 2008-10-08 EP disclosed
EP-1833842-B1 TRIPEPTIDE AND TETRAPEPTIDE SULFONES TELIK INC (US) 2008-10-08 EP disclosed
US-7192918-B2 Tripeptide and tetrapeptide sulfones TELIK, INC. (US) 2007-03-20 US disclosed
US-7129215-B2 Tripeptide and tetrapeptide thioethers TELIK, INC. (US) 2006-10-31 US disclosed
US-20060160749-A1 TRIPEPTIDE AND TETRAPEPTIDE THIOETHERS TELIK, INC. 2006-07-20 US disclosed
US-20060148719-A1 Tripeptide and tetrapeptide sulfones TELIK, INC. 2006-07-06 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-20060160749-A1 TRIPEPTIDE AND TETRAPEPTIDE THIOETHERS MCL1, THPO, MYADM LMNA 4748/4885ALDH1A1 3287/4885TP53 113/4885
US-20060148719-A1 Tripeptide and tetrapeptide sulfones MCL1, MYD88, MYADM LMNA 4319/4885ALDH1A1 3662/4885TP53 75/4885
US-20110200528-A1 CYCLIZED NGR PEPTIDE COMPOUNDS, COMPOSITIONS, AND METHODS OF THEIR USE NGLY1, GRPR, GIPR LMNA 1788/4885ALDH1A1 4878/4885TP53 3125/4885

“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.