Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6161741

CC(=O)N[C@@H](Cc1cccc(/C=N\N)c1)C(N)=O.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 4/20 0.40
PTPN1 P18031 2/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
PAM P19021 1/20 0.40
TACR1 P25103 1/20 0.39
ITGB3 P05106 1/20 0.39
ITGB1 P05556 1/20 0.39
ITGAV P06756 1/20 0.39
ITGA2B P08514 1/20 0.39
ITGB5 P18084 1/20 0.39
CTRB1 P17538 1/20 0.39
PPARG P37231 1/20 0.38
GNPAT O15228 1/20 0.38
PTPN2 P17706 1/20 0.38
CAPN1 P07384 1/20 0.38
CTSB P07858 1/20 0.38
REN P00797 1/20 0.38
KCNA5 P22460 1/20 0.38

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
SCHEMBL6165038 0.92 HPGDS (0.40) HPGDSCTSSCTSKPAMTACR1
Trifluoroacetic Acid SCHEMBL6165425 0.86 CYP3A4 (0.45) HPGDSPTPN1ITGB3ITGB1ITGAV
Trifluoroacetic Acid SCHEMBL6166845 0.80 NOS3 (0.35) CTRB1
Trifluoroacetic Acid SCHEMBL6161743 0.79 F2 (0.50) HPGDS
Trifluoroacetic Acid SCHEMBL6173596 0.76 PRSS1 (0.44)
SCHEMBL6248471 0.76 CTSS (0.61) HPGDSCTSSCTSKPAMTACR1
SCHEMBL15810862 0.76 CTSS (0.61) HPGDSCTSSCTSKPAMTACR1
SCHEMBL15810860 0.76 CTSS (0.61) HPGDSCTSSCTSKPAMTACR1
Trifluoroacetic Acid SCHEMBL6167955 0.76 PTPN1 (0.42) HPGDSPTPN1CTSSCTSKITGB1
Trifluoroacetic Acid SCHEMBL6170992 0.74 ITGB3 (0.40) ITGB3ITGAVITGA2BKCNA5

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 HPGDS 807/4885PTPN1 1142/4885CTSS 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.