Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6167880

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

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
ELANE P08246 1/20 0.34
KMT2A Q03164 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
MAPT P10636 2/20 0.33
PDE3B Q13370 2/20 0.33
PDE3A Q14432 2/20 0.33
HTT P42858 2/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
MEN1 O00255 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PTPN1 P18031 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 SCHEMBL6167885 1.00 SMN1; SMN2 (0.34) SMN1; SMN2ELANEKMT2AL3MBTL1MAPT
Trifluoroacetic Acid SCHEMBL6165992 0.93 KLKB1 (0.33) SMN1; SMN2KMT2AMAPTPDE3BPDE3A
Trifluoroacetic Acid SCHEMBL6165985 0.93 KLKB1 (0.33) SMN1; SMN2KMT2AMAPTPDE3BPDE3A
Trifluoroacetic Acid SCHEMBL7106589 0.93 GRM2 (0.34) SMN1; SMN2KMT2AMAPTPDE3BPDE3A
Trifluoroacetic Acid SCHEMBL7106592 0.93 GRM2 (0.34) SMN1; SMN2KMT2AMAPTPDE3BPDE3A
Trifluoroacetic Acid SCHEMBL6161851 0.93 PDE3B (0.38) SMN1; SMN2KMT2AMAPTPDE3BPDE3A
Trifluoroacetic Acid SCHEMBL6161844 0.93 PDE3B (0.38) SMN1; SMN2KMT2AMAPTPDE3BPDE3A
Trifluoroacetic Acid SCHEMBL6165679 0.91 EPHX2 (0.40) MAPTKDM4E
Trifluoroacetic Acid SCHEMBL6165673 0.91 EPHX2 (0.40) MAPTKDM4E
Trifluoroacetic Acid SCHEMBL6164145 0.91 PDE3B (0.32) SMN1; SMN2KMT2AMAPTPDE3BPDE3A

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
EP-1254136-A4 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD (KR) 2005-06-01 EP claimed
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-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG Chem Investment, Ltd. (KR) 2002-11-06 EP claimed
WO-2001055146-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD. (KR) 2001-08-02 WO 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 SMN1; SMN2 3889/4885ELANE 130/4885KMT2A 2054/4885

“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.