Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL16970580

NCCCCN1C(=O)C=CC1=O.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.53
▸ FAAH O00519 4/20 0.53
▸ PTGS1 P23219 7/20 0.53
▸ PTGS2 P35354 7/20 0.53
▸ HSP90AA1 P07900 1/20 0.52
▸ TLR9 Q9NR96 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ PKM P14618 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ XBP1 P17861 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ RECQL P46063 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ GPR35 Q9HC97 1/20 0.52

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
Trifluoroacetic Acid SCHEMBL6991874 0.98 PTGS1 (0.56) MGLLFAAHPTGS1PTGS2HSP90AA1
Trifluoroacetic Acid SCHEMBL4971470 0.98 PTGS1 (0.56) MGLLFAAHPTGS1PTGS2HSP90AA1
Trifluoroacetic Acid SCHEMBL2385691 0.95 PTGS1 (0.50) MGLLFAAHPTGS1PTGS2HSP90AA1
Trifluoroacetic Acid SCHEMBL247137 0.88 PTGS1 (0.44) MGLLFAAHPTGS1PTGS2HSP90AA1
Trifluoroacetic Acid SCHEMBL4967709 0.85 MGLL (0.47) MGLLFAAHPTGS1PTGS2HSP90AA1
Trifluoroacetic Acid SCHEMBL30433783 0.84 PTGS1 (0.63) MGLLFAAHPTGS1PTGS2HSP90AA1
SCHEMBL2919549 0.84 MGLL (0.76) MGLLFAAHPTGS1PTGS2HSP90AA1
SCHEMBL4174559 0.82 MGLL (0.77) MGLLFAAHPTGS1PTGS2HSP90AA1
SCHEMBL338631 0.82 MGLL (0.77) MGLLFAAHPTGS1PTGS2HSP90AA1
SCHEMBL9999878 0.82 MGLL (0.77) MGLLFAAHPTGS1PTGS2HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10401361-B2 Intracellular organelle peptide targeted enzyme substrates MARKER GENE TECHNOLOGIES, INC. (US) 2019-09-03 — — US disclosed
US-20180120317-A1 INTRACELLULAR ORGANELLE PEPTIDE TARGETED ENZYME SUBSTRATES MARKER GENE TECHNOLOGIES, INC. 2018-05-03 — — US disclosed
US-9841426-B2 Intracellular organelle peptide targeted enzyme substrates MARKER GENE TECHNOLOGIES, INC (US) 2017-12-12 — — US disclosed
US-20150219654-A1 INTRACELLULAR ORGANELLE PEPTIDE TARGETED ENZYME SUBSTRATES MARKER GENE TECHNOLOGIES, INC. 2015-08-06 — — 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-10401361-B2 Intracellular organelle peptide targeted enzyme substrates GLG1, GBA3, MIA3 MGLL 911/4885FAAH 2601/4885PTGS1 3683/4885
US-20180120317-A1 INTRACELLULAR ORGANELLE PEPTIDE TARGETED ENZYME SUBSTRATES GLG1, GBA3, MIA3 MGLL 911/4885FAAH 2601/4885PTGS1 3683/4885
US-20150219654-A1 INTRACELLULAR ORGANELLE PEPTIDE TARGETED ENZYME SUBSTRATES GLG1, GBA3, MIA3 MGLL 911/4885FAAH 2601/4885PTGS1 3683/4885

“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.

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