Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6165673

CCOC(=O)c1cn(Cc2cccc(/C=N\N)c2)cc1Cc1ccc(C(=O)NCc2ccccc2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.40
PPARG P37231 9/20 0.40
KLKB1 P03952 1/20 0.38
PPARA Q07869 2/20 0.37
S1PR3 Q99500 2/20 0.37
MAPK14 Q16539 1/20 0.36
TP53 P04637 1/20 0.36
F10 P00742 1/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 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 SCHEMBL6165679 1.00 EPHX2 (0.40) EPHX2PPARGKLKB1PPARAS1PR3
Trifluoroacetic Acid SCHEMBL6165985 0.93 KLKB1 (0.33) EPHX2PPARGKLKB1F10MAPT
Trifluoroacetic Acid SCHEMBL6165992 0.93 KLKB1 (0.33) EPHX2PPARGKLKB1F10MAPT
Trifluoroacetic Acid SCHEMBL6173094 0.92 MAPT (0.39) TP53MAPTKDM4E
Trifluoroacetic Acid SCHEMBL6173089 0.92 MAPT (0.39) TP53MAPTKDM4E
Trifluoroacetic Acid SCHEMBL6161844 0.92 PDE3B (0.38) TP53MAPTKDM4E
Trifluoroacetic Acid SCHEMBL6161851 0.92 PDE3B (0.38) TP53MAPTKDM4E
Trifluoroacetic Acid SCHEMBL6167880 0.91 SMN1; SMN2 (0.34) MAPTKDM4E
Trifluoroacetic Acid SCHEMBL6167885 0.91 SMN1; SMN2 (0.34) MAPTKDM4E
Trifluoroacetic Acid SCHEMBL7106589 0.90 GRM2 (0.34) F10MAPTKDM4E

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
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US claimed
EP-1254136-A4 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD (KR) 2005-06-01 EP disclosed
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US disclosed
EP-1254136-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG Chem Investment, Ltd. (KR) 2002-11-06 EP disclosed
WO-2001055146-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD. (KR) 2001-08-02 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 (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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof F2, F12, TFPI EPHX2 1021/4885PPARG 998/4885KLKB1 530/4885

“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.