Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5484944

Cc1nc2c(cc1CO)CN(CC(=O)c1cc(N3CCCC3)c(OCCCC(=O)O)c(C(C)(C)C)c1)C2=N.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2R P25116 10/20 0.43
RARA P10276 3/20 0.31
RARB P10826 3/20 0.31
RARG P13631 3/20 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
SCHEMBL1731645 0.97 F2R (0.43) F2RRARARARBRARG
SCHEMBL5484953 0.91 F2R (0.42) F2R
SCHEMBL5484949 0.91 F2R (0.42) F2R
Trifluoroacetic Acid SCHEMBL5485334 0.85 F2R (0.44) F2RRARARARBRARG
Bromide SCHEMBL1731407 0.83 F2R (0.43) F2RRARARARBRARG
Bromide SCHEMBL1732221 0.83 F2R (0.44) F2RRARARARBRARG
Trifluoroacetic Acid SCHEMBL4262444 0.83 F2R (0.42) F2RRARARARBRARG
Bromide SCHEMBL1729732 0.82 F2R (0.45) F2RRARARARBRARG
Bromide SCHEMBL1732012 0.81 F2R (0.44) F2RRARARARBRARG
Bromide SCHEMBL1732158 0.81 F2R (0.44) F2RRARARARBRARG

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 2290/4885RARA 2536/4885RARB 2657/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885RARA 2540/4885RARB 2647/4885

“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.