Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4687014

N=C(N)c1ccc(CC(=O)C(=O)O)c(OCCNC(=O)c2ccc3nc(N)sc3c2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.65
F2 P00734 3/20 0.65
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP2D6 P10635 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
LMNA P02545 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TMPRSS15 P98073 1/20 0.41

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
SCHEMBL4687024 0.89 F10 (0.54) F10F2ALDH1A1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL4684666 0.85 F10 (0.67) F10F2NPC1
Trifluoroacetic Acid SCHEMBL4685812 0.84 F10 (0.45) F10F2ALDH1A1CYP2D6CYP3A4
Trifluoroacetic Acid SCHEMBL4687003 0.80 F10 (0.64) F10F2NPC1
SCHEMBL14132315 0.80 F10 (1.00) F10F2NPC1RAB9A
Trifluoroacetic Acid SCHEMBL3897265 0.79 F10 (0.75) F10F2ALDH1A1KMT2ANPC1
Trifluoroacetic Acid SCHEMBL3899621 0.79 F10 (0.75) F10F2ALDH1A1KMT2ANPC1
SCHEMBL4685823 0.79 F10 (0.42) F10F2ALDH1A1CYP2D6CYP3A4
Trifluoroacetic Acid SCHEMBL3905842 0.79 F10 (0.72) F10F2KMT2ACYP3A4CYP2C9
Trifluoroacetic Acid SCHEMBL3905673 0.77 F10 (0.92) F10F2

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
EP-1236712-B1 AMIDINOPHENYLPYRUVIC ACID DERIVATIVE AJINOMOTO KK (JP) 2008-08-06 EP disclosed
US-6710056-B2 PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF HAVE AN EXCELLENT ANTAGONISTIC EFFECT AGAINST ACTIVATED BLOOD COAGULATION FACTOR VII. AJINOMOTO CO., INC. (JP) 2004-03-23 US disclosed
US-20030109547-A1 Amidinophenylpyruvic acid derivatives AJINOMOTO CO. INC (JP) 2003-06-12 US disclosed
EP-1236712-A1 AMIDINOPHENYLPYRUVIC ACID DERIVATIVE Ajinomoto Co., Inc. (JP) 2002-09-04 EP 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-20030109547-A1 Amidinophenylpyruvic acid derivatives HABP2, F2, F7 F10 26/4885F2 2/4885ALDH1A1 622/4885

“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.