Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6168938

CS(=O)(=O)N[C@@H](Cc1cccc(C(=N)N)c1)C(=O)NCc1ccc(-c2cc(F)ccc2C#N)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TMPRSS6 Q8IU80 14/20 0.56
F2 P00734 13/20 0.56
F10 P00742 6/20 0.42
ST14 Q9Y5Y6 3/20 0.40
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
F7 P08709 1/20 0.38

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 SCHEMBL6171857 0.92 F2 (0.60) TMPRSS6F2F10PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL6171416 0.88 TMPRSS6 (0.58) TMPRSS6F2F10ST14PRSS1
Trifluoroacetic Acid SCHEMBL6169336 0.88 TMPRSS6 (0.56) TMPRSS6F2F10ST14
Trifluoroacetic Acid SCHEMBL6167095 0.82 F10 (0.54) TMPRSS6F2F10PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL6173092 0.81 F2 (0.54) TMPRSS6F2F10PRSS1F7
Trifluoroacetic Acid SCHEMBL6171547 0.81 F2 (0.53) TMPRSS6F2F10PRSS1F7
Trifluoroacetic Acid SCHEMBL6161833 0.80 F2 (0.48) TMPRSS6F2F10PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL6164683 0.80 F9 (0.45) TMPRSS6F2F10PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL6166755 0.79 F10 (0.54) F2F10PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6172396 0.79 F2 (0.51) TMPRSS6F2F10PRSS1F7

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
EP-1254136-A4 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD (KR) 2005-06-01 EP claimed
EP-1254136-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG Chem Investment, Ltd. (KR) 2002-11-06 EP claimed
WO-2001055146-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD. (KR) 2001-08-02 WO claimed