Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6165985

CCOC(=O)c1cn(Cc2cccc(/C=N\N)c2)cc1Cc1ccc(C(=O)NC)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 2/20 0.33
MAPT P10636 1/20 0.33
PDE3B Q13370 3/20 0.33
PDE3A Q14432 3/20 0.33
EPHX2 P34913 4/20 0.32
PPARG P37231 3/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
AGTR2 P50052 1/20 0.32
P2RY14 Q15391 1/20 0.32
F10 P00742 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
OPRK1 P41145 1/20 0.32

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 SCHEMBL6165992 1.00 KLKB1 (0.33) KLKB1MAPTPDE3BPDE3AEPHX2
Trifluoroacetic Acid SCHEMBL6165673 0.93 EPHX2 (0.40) KLKB1MAPTEPHX2PPARGF10
Trifluoroacetic Acid SCHEMBL6165679 0.93 EPHX2 (0.40) KLKB1MAPTEPHX2PPARGF10
Trifluoroacetic Acid SCHEMBL6167880 0.93 SMN1; SMN2 (0.34) MAPTPDE3BPDE3AKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL6167885 0.93 SMN1; SMN2 (0.34) MAPTPDE3BPDE3AKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL6173089 0.93 MAPT (0.39) MAPTKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL6173094 0.93 MAPT (0.39) MAPTKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL7106592 0.92 GRM2 (0.34) MAPTPDE3BPDE3AKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL7106589 0.92 GRM2 (0.34) MAPTPDE3BPDE3AKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL6161851 0.92 PDE3B (0.38) MAPTPDE3BPDE3AKMT2ASMN1; SMN2

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 KLKB1 530/4885MAPT 4356/4885PDE3B 211/4885

“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.