Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5488769

CCOc1c(C)nc2c(c1C)CN(CC(=O)c1ccc(OCC(=O)O)c(C(C)(C)C)c1)C2=N.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2R P25116 7/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.36
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PDE5A O76074 1/20 0.32
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
CYP2C19 P33261 1/20 0.30

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
Bromide SCHEMBL1729409 0.95 F2R (0.39) F2RPTGDR2MEN1KMT2ATHRA
SCHEMBL5488774 0.90 F2R (0.36) F2RTHRATHRB
Trifluoroacetic Acid SCHEMBL1732887 0.89 F2R (0.36) F2RPDE5A
Bromide SCHEMBL5490223 0.85 F2R (0.40) F2RTHRATHRB
SCHEMBL6544585 0.84 F2R (0.38) F2RPDE5A
SCHEMBL1732890 0.83 F2R (0.35) F2R
Bromide SCHEMBL1731229 0.83 F2R (0.39) F2R
Bromide SCHEMBL1729928 0.83 F2R (0.38) F2R
Trifluoroacetic Acid SCHEMBL1731651 0.83 F2R (0.37) F2R
Trifluoroacetic Acid SCHEMBL1731674 0.82 PTGDR2 (0.38) F2RPTGDR2MEN1KMT2ATHRA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244730-B2 2-iminopyrrolidine derivatives EISAI CO., LTD (JP) 2007-07-17 US disclosed
US-20050245592-A1 2-Iminopyrrolidine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-11-03 US disclosed
US-20050004204-A1 2-Iminopyrrolidine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-06 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 (2 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-20050245592-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2290/4885PTGDR2 549/4885MEN1 891/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885PTGDR2 544/4885MEN1 859/4885

“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.