Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6163932

CC1=C(N)C(=NO)CC=C1[C@H]1C[C@H]1C(=O)Nc1ccc(-c2ccccc2S(N)(=O)=O)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.43
PRSS1 P07477 12/20 0.43
F2 P00734 7/20 0.43
PRSS2 P07478 7/20 0.41
PRSS3 P35030 7/20 0.41

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 SCHEMBL6163840 0.92 FPR2 (0.39) F10PRSS1F2PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6163933 0.90 F10 (0.36) F10PRSS1F2PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL7105827 0.90 F10 (0.42) F10PRSS1F2PRSS2PRSS3
SCHEMBL6165680 0.88 F10 (0.41) F10PRSS1F2PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6164863 0.86 MEN1 (0.34) F10
SCHEMBL6167760 0.83 F10 (0.41) F10PRSS1F2PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6165931 0.80 ABL1 (0.33)
SCHEMBL6164989 0.77 F10 (0.38) F10PRSS1F2PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6167765 0.76 NR3C2 (0.33) F10
Trifluoroacetic Acid SCHEMBL7108370 0.76 F10 (0.58) F10PRSS1F2PRSS2PRSS3

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 F10 11/4885PRSS1 43/4885F2 1/4885

“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.