Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL17537149

CC(C)c1cccc([C@H](C)C2CC2)c1OCOC(=O)[C@@H](N)Cc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.37
GLRA1 P23415 2/20 0.36
ALPI P09923 1/20 0.34
PKM P14618 1/20 0.34
PTGS1 P23219 1/20 0.34
XIAP P98170 1/20 0.34
SLC7A5 Q01650 1/20 0.34
DPP4 P27487 3/20 0.34
DPP7 Q9UHL4 1/20 0.34
OPRK1 P41145 3/20 0.34
SOAT2 O75908 1/20 0.33
SOAT1 P35610 1/20 0.33
F2 P00734 1/20 0.33
PTPN1 P18031 1/20 0.33

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 SCHEMBL28110030 1.00 TYR (0.37) TYRGLRA1ALPIPKMPTGS1
SCHEMBL17549504 0.95 TYR (0.40) TYRGLRA1ALPIPKMPTGS1
Trifluoroacetic Acid SCHEMBL17537129 0.89 DPP4 (0.33) GLRA1DPP4DPP7
Trifluoroacetic Acid SCHEMBL17537151 0.87 DPP4 (0.36) GLRA1DPP4DPP7
Trifluoroacetic Acid SCHEMBL17537078 0.85 DPP4 (0.35) GLRA1DPP4DPP7
Trifluoroacetic Acid SCHEMBL17537211 0.85 DPP7 (0.38) DPP4DPP7
Trifluoroacetic Acid SCHEMBL17537104 0.84 DPP4 (0.34) GLRA1DPP4DPP7
Trifluoroacetic Acid SCHEMBL28110534 0.84 DPP4 (0.34) GLRA1DPP4DPP7
SCHEMBL17549495 0.81 LARS1 (0.33) SOAT2SOAT1
SCHEMBL21154976 0.81 LARS1 (0.33) SOAT2SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9517988-B2 Phenol derivative and preparation method and use in medicine thereof SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2016-12-13 US disclosed
EP-2995604-A1 PHENOL DERIVATIVE AND PREPARATION METHOD AND USE IN MEDICINE THEREOF Sichuan Haisco Pharmaceutical Co., Ltd. (CN) 2016-03-16 EP disclosed
US-20160060197-A1 PHENOL DERIVATIVE AND PREPARATION METHOD AND USE IN MEDICINE THEREOF SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2016-03-03 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-20160060197-A1 PHENOL DERIVATIVE AND PREPARATION METHOD AND USE IN MEDICINE THEREOF CYP2D6, CYP2B6, CYP2A6 TYR 73/4885GLRA1 4066/4885ALPI 311/4885

“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.