Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7108467

CN(C)C(=O)[C@H](Cc1ccnc(C(=N)N)c1)NC(=O)c1ccc(-c2ccccc2C#N)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.41
F10 P00742 4/20 0.40
CTSS P25774 8/20 0.39
CTSB P07858 5/20 0.39
CTSK P43235 5/20 0.39
CTSL P07711 6/20 0.39
CTSV O60911 1/20 0.38
SCN9A Q15858 1/20 0.38
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38
F2 P00734 2/20 0.37
PRSS1 P07477 2/20 0.37
PYGL P06737 1/20 0.37
BCL2A1 Q16548 1/20 0.37
PPARG P37231 1/20 0.37
CTSD P07339 1/20 0.37
BACE1 P56817 1/20 0.37
BACE2 Q9Y5Z0 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 SCHEMBL7106869 0.90 F10 (0.44) PTPN1F10CTSSCTSBCTSK
Trifluoroacetic Acid SCHEMBL6166384 0.89 PTPN1 (0.42) PTPN1F10CTSSCTSBCTSK
Trifluoroacetic Acid SCHEMBL6164347 0.78 F10 (0.58) F10F2PRSS1
Trifluoroacetic Acid SCHEMBL6170322 0.77 CTSS (0.52) F10CTSSCTSBCTSKCTSL
Trifluoroacetic Acid SCHEMBL7106872 0.76 PTPN1 (0.42) PTPN1F10CTSSCTSBCTSK
Trifluoroacetic Acid SCHEMBL7106866 0.76 PTPN1 (0.42) PTPN1F10CTSSCTSBCTSK
Trifluoroacetic Acid SCHEMBL6166382 0.75 PTPN1 (0.42) PTPN1CTSSCTSBCTSKCTSL
Trifluoroacetic Acid SCHEMBL6166385 0.75 PTPN1 (0.42) PTPN1CTSSCTSBCTSKCTSL
Trifluoroacetic Acid SCHEMBL6166755 0.70 F10 (0.54) F10F2PRSS1
Trifluoroacetic Acid SCHEMBL6164351 0.70 CTSB (0.43) PTPN1F10CTSSCTSBCTSK

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 2 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
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US 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 PTPN1 1142/4885F10 11/4885CTSS 354/4885

“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.