Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6164542

CS(=O)(=O)NC(=O)[C@@H](N)Cc1cccc(C(=N)N)c1.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 10/20 0.50
TMPRSS6 Q8IU80 9/20 0.50
PLG P00747 3/20 0.46
F10 P00742 2/20 0.46
SLC7A5 Q01650 2/20 0.45
PLAU P00749 1/20 0.43

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 SCHEMBL6165429 0.82 F2 (0.55) F2TMPRSS6PLGF10PLAU
SCHEMBL16836845 0.79 ALPI (0.56) SLC7A5
SCHEMBL16727787 0.79 ALPI (0.56) SLC7A5
Trifluoroacetic Acid SCHEMBL6170995 0.78 F2 (0.47) F2TMPRSS6PLGF10
Trifluoroacetic Acid SCHEMBL6169382 0.78 PRSS1 (0.61) F2PLGF10
Trifluoroacetic Acid SCHEMBL6161743 0.77 F2 (0.50) F2TMPRSS6PLGF10
Trifluoroacetic Acid SCHEMBL6170694 0.75 F2 (0.54) F2TMPRSS6PLGF10
SCHEMBL288337 0.75 SLC7A5 (0.65) SLC7A5
SCHEMBL202409 0.75 SLC7A5 (0.65) SLC7A5
SCHEMBL31538733 0.75 SLC7A5 (0.65) SLC7A5

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 6 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
EP-1254136-A4 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD (KR) 2005-06-01 EP 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