Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5490717

CCOc1cc2c(c(F)c1OCC)C(=N)N(CC(=O)c1cc(N3CCCCC3)c(OCC(=O)O)c(C(C)(C)C)c1)C2.O=C(O)C(F)(F)F

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F2R P25116 10/20 0.71
MAPT P10636 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 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
Trifluoroacetic Acid SCHEMBL1731390 0.99 F2R (0.72) F2RMAPTGAASMN1; SMN2
Bromide SCHEMBL6362254 0.96 F2R (0.75) F2RMAPTKDM4EALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL1728947 0.93 F2R (0.81) F2RKDM4EALDH1A1LMNAL3MBTL1
Trifluoroacetic Acid SCHEMBL1731650 0.92 F2R (0.69) F2R
Trifluoroacetic Acid SCHEMBL5491057 0.91 F2R (0.69) F2R
SCHEMBL5490725 0.90 F2R (0.68) F2R
Trifluoroacetic Acid SCHEMBL1729320 0.90 F2R (0.65) F2RALDH1A1GAA
SCHEMBL1731393 0.90 F2R (0.69) F2RMAPT
Bromide SCHEMBL5493294 0.90 F2R (0.85) F2RKDM4EALDH1A1LMNAL3MBTL1
Trifluoroacetic Acid SCHEMBL1729653 0.89 F2R (0.62) F2R

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 2290/4885MAPT 3483/4885KDM4E 3161/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885MAPT 3440/4885KDM4E 3132/4885

“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.