Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4032980

Nc1cc(OCc2ccccc2)cc(OCc2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
MAOB P27338 3/20 0.55
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
MAOA P21397 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PARP10 Q53GL7 1/20 0.49
NR4A2 P43354 2/20 0.48
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
NR4A1 P22736 1/20 0.47
NR4A3 Q92570 1/20 0.47
SPHK2 Q9NRA0 1/20 0.46
SPHK1 Q9NYA1 1/20 0.46
PTPN2 P17706 1/20 0.46
PTPN1 P18031 1/20 0.46
PTPRB P23467 1/20 0.46

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
SCHEMBL9170360 0.85 MAOB (0.72) MEN1KMT2AMAOBGAAMAPT
Hydrochloric Acid SCHEMBL3275739 0.84 MAOB (0.70) MEN1KMT2AMAOBGAAMAPT
SCHEMBL4279566 0.80 MAOB (0.57) MEN1KMT2AMAOBGAAMAPT
SCHEMBL7110511 0.78 MAOB (0.67) MEN1KMT2AMAOBGAAMAPT
SCHEMBL16551263 0.78 MAOB (0.67) MEN1KMT2AMAOBGAAMAPT
Trifluoroacetic Acid SCHEMBL3319853 0.77 MEN1 (0.52) MEN1KMT2AMAOBPARP10NR4A2
Trifluoroacetic Acid SCHEMBL7420441 0.77 FFAR1 (0.60) MAOBPARP10NR4A2FFAR1FFAR4
Trifluoroacetic Acid SCHEMBL17136548 0.77 MAOB (0.63) MAOBMAPTFFAR1FFAR4
SCHEMBL21483726 0.77 MEN1 (0.59) MEN1KMT2AMAOBGAAMAPT
SCHEMBL417403 0.77 KMT2A (0.59) MEN1KMT2AMAOBGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1444211-B1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2009-01-21 EP disclosed
US-20070088044-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB 2007-04-19 US disclosed
US-20050054662-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB (SE) 2005-03-10 US disclosed
EP-1444211-A2 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS AstraZeneca AB (SE) 2004-08-11 EP disclosed
WO-2003040109-A2 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2003-05-15 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 (2 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-20050054662-A1 Quinazoline derivatives as antitumor agents ERBB2, ERBB3, ABL1 MEN1 1212/4885KMT2A 1693/4885MAOB 1671/4885
US-20070088044-A1 Quinazoline derivatives as antitumor agents ERBB2, EGFR, ERBB4 MEN1 2352/4885KMT2A 1786/4885MAOB 1215/4885

“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.