Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30801355

NNC(=O)c1ccc[n+](Cc2cn(-c3ccccc3)nn2)c1.O=C(O)C(F)(F)F.O=C([O-])C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MIF P14174 2/20 0.43
CYP2D6 P10635 1/20 0.42
MAOA P21397 3/20 0.39
MAOB P27338 2/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
NOTUM Q6P988 2/20 0.38
NPC1 O15118 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
POLB P06746 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
DDX3X O00571 1/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
APP P05067 2/20 0.36

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 SCHEMBL30801352 0.90 MIF (0.45) MIFMAOAMAOBL3MBTL1NOTUM
Trifluoroacetic Acid SCHEMBL23326865 0.86 L3MBTL1 (0.43) MIFL3MBTL1NOTUMNPC1POLB
SCHEMBL23326705 0.77 MAOA (0.43) MIFMAOAMAOBL3MBTL1NOTUM
Trifluoroacetic Acid SCHEMBL23326692 0.77 L3MBTL1 (0.47) MIFL3MBTL1NOTUMNPC1POLB
Formic Acid SCHEMBL30801354 0.74 NOTUM (0.38) MIFMAOAMAOBL3MBTL1NOTUM
Formic Acid SCHEMBL30801353 0.74 NOTUM (0.38) MIFMAOAMAOBL3MBTL1NOTUM
SCHEMBL23326579 0.69 GLA (0.46) MIFMAOAL3MBTL1NOTUMNPC1
SCHEMBL30801359 0.67 L3MBTL1 (0.55) MIFMAOAL3MBTL1NOTUMNPC1
Benzoic Acid Hydrazide SCHEMBL5591378 0.65 CES1 (0.52) CYP2D6L3MBTL1NPC1HDAC8ALDH1A1
Trifluoroacetic Acid SCHEMBL21632234 0.65 ALDH1A1 (0.36) CYP2D6L3MBTL1POLBALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11885818-B2 Reagent for mass spectrometry ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2024-01-30 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 (1 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-11885818-B2 Reagent for mass spectrometry SRMS, PTMS, MMAB MIF 1934/4885CYP2D6 589/4885MAOA 854/4885

“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.