Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4684485

N=C(N)c1ccc(CC(=O)C(=O)O)c(OC[C@@H](CCC(=O)O)NC(=O)c2cc3c(cc2Br)CCO3)c1.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.44
F2 P00734 4/20 0.42
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
PRSS1 P07477 2/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
F7 P08709 1/20 0.30
F3 P13726 1/20 0.30
TMPRSS15 P98073 1/20 0.30

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
SCHEMBL4684495 0.91 F10 (0.41) F10F2TAS1R3TAS1R1PRSS1
Trifluoroacetic Acid SCHEMBL4681055 0.90 F10 (0.43) F10F2TAS1R3TAS1R1PRSS1
Trifluoroacetic Acid SCHEMBL4685301 0.90 F10 (0.48) F10F2TAS1R3TAS1R1PRSS1
SCHEMBL4681065 0.82 F10 (0.40) F10F2TAS1R3TAS1R1PRSS1
SCHEMBL4685309 0.81 F10 (0.45) F10F2TAS1R3TAS1R1PRSS1
Trifluoroacetic Acid SCHEMBL4680876 0.80 F10 (0.52) F10F2PRSS1F7F3
Trifluoroacetic Acid SCHEMBL4687004 0.79 F10 (0.51) F10F2
Trifluoroacetic Acid SCHEMBL4684989 0.78 F10 (0.46) F10F2TAS1R3TAS1R1PRSS1
Trifluoroacetic Acid SCHEMBL4681672 0.78 F10 (0.48) F10F2F7F3TMPRSS15
Trifluoroacetic Acid SCHEMBL4682216 0.78 F10 (0.48) F10F2PRSS1PRSS2PRSS3

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 2/4885TAS1R3 3011/4885

“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.