Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6165732

CNS(=O)(=O)c1ccccc1-c1ccc(NC(=O)[C@@H]2C[C@@H]2c2cccc(C=NN)c2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 1/20 0.42
F10 P00742 13/20 0.40
PRSS1 P07477 8/20 0.40
F2 P00734 2/20 0.40
DEGS1 O15121 1/20 0.39
FPR2 P25090 1/20 0.39
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
NAMPT P43490 1/20 0.37

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 SCHEMBL6167450 0.87 HDAC3 (0.43) SCN3ADEGS1NAMPT
Trifluoroacetic Acid SCHEMBL6163010 0.86 DEGS1 (0.42) SCN3ADEGS1NAMPT
Trifluoroacetic Acid SCHEMBL6163957 0.86 DEGS1 (0.42) SCN3AF10PRSS1F2DEGS1
SCHEMBL6163523 0.86 F10 (0.44) SCN3AF10PRSS1F2DEGS1
SCHEMBL6164345 0.85 F10 (0.49) F10
SCHEMBL6166356 0.85 F10 (0.49) F10
Trifluoroacetic Acid SCHEMBL6165729 0.85 F10 (0.55) F10PRSS1F2PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6165072 0.83 HDAC3 (0.42) F10PRSS1F2DEGS1PRSS2
Trifluoroacetic Acid SCHEMBL6168316 0.82 NAMPT (0.38) SCN3AF10PRSS1F2DEGS1
Trifluoroacetic Acid SCHEMBL6165364 0.82 SCN3A (0.40) SCN3AF10PRSS1F2DEGS1

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 8 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
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-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
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 SCN3A 539/4885F10 11/4885PRSS1 43/4885

“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.