Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1730841

COc1cc2c(c(F)c1OC)C(=N)N(CC(=O)c1ccc(OCCCCC(=O)O)c(C(C)(C)C)c1)C2.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F2R P25116 8/20 0.52
THRA P10827 3/20 0.39
THRB P10828 3/20 0.39
PPARA Q07869 1/20 0.34
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
STING1 Q86WV6 2/20 0.32
PDE4B Q07343 2/20 0.32
RBP4 P02753 1/20 0.32
KCNH2 Q12809 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 SCHEMBL1729561 0.92 F2R (0.52) F2RTHRATHRBPDE4B
SCHEMBL1730845 0.90 F2R (0.49) F2RTHRATHRBKDM4ENPC1
Bromide SCHEMBL1731329 0.88 F2R (0.49) F2RTHRATHRBPPARAKDM4E
Bromide SCHEMBL5485994 0.87 F2R (0.59) F2RFFAR4STING1KCNH2
Trifluoroacetic Acid SCHEMBL1732214 0.87 F2R (0.49) F2RKDM4ENPC1MAPTRAB9A
Hydrochloric Acid SCHEMBL1729446 0.87 F2R (0.58) F2RTHRATHRBKDM4ENPC1
Trifluoroacetic Acid SCHEMBL1730670 0.86 F2R (0.62) F2RFFAR4KCNH2
Bromide SCHEMBL5484855 0.86 F2R (0.60) F2RKDM4ENPC1MAPTRAB9A
Bromide SCHEMBL1731116 0.84 F2R (0.43) F2RTHRATHRBPPARAKDM4E
Hydrochloric Acid SCHEMBL1732023 0.84 F2R (0.58) F2RTHRATHRBKDM4ENPC1

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 2290/4885THRA 2030/4885THRB 2315/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885THRA 2034/4885THRB 2297/4885

“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.