Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL504170

O=C(O)C(F)(F)F.O=C1CCC(=O)N1O

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32
PKM P14618 2/20 0.32
ALDH1A1 P00352 1/20 0.32
ITGB1 P05556 2/20 0.31
ITGA5 P08648 2/20 0.31
ITGA4 P13612 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGAV P06756 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
Bicarbonate SCHEMBL14917 0.82 CA1 (0.38) CA12CA1CA9PKMALDH1A1
Bicarbonate SCHEMBL6150295 0.82 CA1 (0.38) CA12CA1CA9PKMALDH1A1
Pivalate SCHEMBL10534446 0.81 POLB (0.34) CA12CA1CA9ALDH1A1
Oxalic Acid SCHEMBL9728851 0.79 CA12 (0.37) CA12CA1CA9PKMALDH1A1
Trifluoroacetic Acid SCHEMBL2053629 0.79 CA12 (0.31) CA12CA1CA9PKMALDH1A1
Trifluoroacetic Acid SCHEMBL22660281 0.79 GAA (0.32) CA12CA1CA9PKMALDH1A1
SCHEMBL338264 0.79 KDM4E (0.34) CA12CA1CA9ALDH1A1
SCHEMBL1123 0.79
SCHEMBL785147 0.79
SCHEMBL4891780 0.77 KDM4E (0.36) CA12CA1CA9PKMALDH1A1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11867698-B2 Fluorogenic pH sensitive dyes and their method of use Life Technologies Corporation (US) 2024-01-09 US disclosed
US-20210041465-A1 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE Life Technologies Corporation 2021-02-11 US disclosed
US-10845373-B2 Fluorogenic pH sensitive dyes and their method of use Life Technologies Corporation (US) 2020-11-24 US disclosed
US-20180238912-A1 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE Life Technologies Corporation 2018-08-23 US disclosed
US-9939454-B2 Fluorogenic pH sensitive dyes and their method of use Life Technologies Corporation (US) 2018-04-10 US disclosed
US-9910051-B2 Fluorogenic pH sensitive dyes and their method of use Life Technologies Corporation (US) 2018-03-06 US disclosed
US-9841426-B2 Intracellular organelle peptide targeted enzyme substrates MARKER GENE TECHNOLOGIES, INC (US) 2017-12-12 US disclosed
US-9677115-B2 Enzyme substrates for visualizing acidic organelles MARKER GENE TECHNOLOGIES, INC. (US) 2017-06-13 US disclosed
US-20160139158-A1 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE Life Technologies Corporation 2016-05-19 US disclosed
US-20150219654-A1 INTRACELLULAR ORGANELLE PEPTIDE TARGETED ENZYME SUBSTRATES MARKER GENE TECHNOLOGIES, INC. 2015-08-06 US disclosed
US-20120028285-A1 Clickable cross-linker NATIONAL SCIENCE FOUNDATION 2012-02-02 US disclosed
WO-2012006603-A2 CLICKABLE CROSS-LINKER CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-01-12 WO disclosed
US-20100233744-A1 Enzyme substrates for visualizing acidic organelles MARKER GENE TECHNOLOGIES, INC. 2010-09-16 US disclosed
EP-2064290-A2 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE Life Technologies Corporation (US) 2009-06-03 EP disclosed
US-20080274907-A1 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE INVITROGEN CORPORATION (US) 2008-11-06 US disclosed
WO-2008076524-A2 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE Life Technologies Corporation (US) 2008-06-26 WO disclosed
US-7304168-B2 Photo-caged fluorescent molecules BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM (US) 2007-12-04 US disclosed
US-20050042662-A1 Photo-caged fluorescent molecules BOARD OF REGENTS (US) 2005-02-24 US disclosed
EP-1337550-A2 HEPATITIS C TRIPEPTIDE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-08-27 EP disclosed
WO-2002060926-A2 HEPATITIS C TRIPEPTIDE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-08-08 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 (8 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-20120028285-A1 Clickable cross-linker MTCL3, SPPL2B, VIP CA12 1390/4885CA1 599/4885CA9 2904/4885
US-20180238912-A1 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE SLC11A2, MAN2B1, CD47 CA12 1018/4885CA1 422/4885CA9 664/4885
US-20080274907-A1 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE SLC11A2, MAN2B1, CD47 CA12 1018/4885CA1 422/4885CA9 664/4885
US-10845373-B2 Fluorogenic pH sensitive dyes and their method of use SLC11A2, MAN2B1, CD47 CA12 1018/4885CA1 422/4885CA9 664/4885
US-20150219654-A1 INTRACELLULAR ORGANELLE PEPTIDE TARGETED ENZYME SUBSTRATES GLG1, GBA3, MIA3 CA12 3608/4885CA1 2870/4885CA9 4006/4885
US-20210041465-A1 FLUOROGENIC PH SENSITIVE DYES AND THEIR METHOD OF USE SLC11A2, MAN2B1, CD47 CA12 1018/4885CA1 422/4885CA9 664/4885
US-11867698-B2 Fluorogenic pH sensitive dyes and their method of use SLC11A2, MAN2B1, CD47 CA12 1018/4885CA1 422/4885CA9 664/4885
US-20050042662-A1 Photo-caged fluorescent molecules GJA1, GJB2, CBX7 CA12 2847/4885CA1 2713/4885CA9 3119/4885

“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.