Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1728947

CCOc1cc2c(c(F)c1OCC)C(=N)N(CC(=O)c1cc(N3CCOCC3)c(OCC(=O)O)c(C(C)(C)C)c1)C2.O=C(O)C(F)(F)F

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2R P25116 13/20 0.81
ALDH1A1 P00352 3/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
GAA P10253 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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 SCHEMBL5493294 0.97 F2R (0.85) F2RALDH1A1L3MBTL1SMN1; SMN2GAA
Trifluoroacetic Acid SCHEMBL1731390 0.94 F2R (0.72) F2RSMN1; SMN2GAA
Trifluoroacetic Acid SCHEMBL5490717 0.93 F2R (0.71) F2RALDH1A1L3MBTL1SMN1; SMN2GAA
Bromide SCHEMBL1729548 0.92 F2R (0.93) F2RALDH1A1L3MBTL1SMN1; SMN2GAA
SCHEMBL1728953 0.91 F2R (0.79) F2RALDH1A1L3MBTL1SMN1; SMN2GAA
Bromide SCHEMBL6362254 0.90 F2R (0.75) F2RALDH1A1L3MBTL1SMN1; SMN2GAA
Atopaxar SCHEMBL30175034 0.90 F2R (1.00) F2RALDH1A1L3MBTL1SMN1; SMN2GAA
Atopaxar SCHEMBL1730339 0.90 F2R (1.00) F2RALDH1A1L3MBTL1SMN1; SMN2GAA
Atopaxar SCHEMBL1728925 0.89 F2R (1.00) F2RALDH1A1L3MBTL1SMN1; SMN2GAA
Atopaxar SCHEMBL29904776 0.89 F2R (1.00) F2RALDH1A1L3MBTL1SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1391451-B1 2-IMINOPYRROLIDINE DERIVATES EISAI R&D MAN CO LTD (JP) 2011-11-23 EP disclosed
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 2290/4885ALDH1A1 443/4885L3MBTL1 3538/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885ALDH1A1 437/4885L3MBTL1 3543/4885

“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.