Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6162879

CCOC(=O)c1csc(C(Cc2cccc(C=NN)c2)NC(=O)c2ccc(-c3ccccc3S(N)(=O)=O)cc2)n1.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 3/20 0.46
CCR3 P51677 1/20 0.42
F10 P00742 12/20 0.40
PTPN1 P18031 1/20 0.39
PRSS1 P07477 8/20 0.38
PRSS2 P07478 7/20 0.38
PRSS3 P35030 7/20 0.38
F2 P00734 5/20 0.38
ABCB1 P08183 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PLG P00747 1/20 0.36
PLAT P00750 1/20 0.36
F7 P08709 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 SCHEMBL7107207 1.00 PTPRB (0.46) PTPRBCCR3F10PTPN1PRSS1
Trifluoroacetic Acid SCHEMBL7107447 0.91 PTPRB (0.46) PTPRBCCR3F10PTPN1PRSS1
Trifluoroacetic Acid SCHEMBL6179765 0.89 F10 (0.52) PTPRBF10PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6167616 0.85 F10 (0.48) F10PRSS1PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6167607 0.85 F10 (0.48) F10PRSS1PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6166135 0.82 F10 (0.49) F10PRSS1PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6166128 0.82 F10 (0.49) F10PRSS1PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6162418 0.80 F10 (0.51) F10PRSS1PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6162400 0.80 F10 (0.51) F10PRSS1PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6165828 0.76 ALDH1A1 (0.44) F10PRSS1PRSS2PRSS3F2

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 PTPRB 3348/4885CCR3 1808/4885F10 11/4885

“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.