Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6798563

CC#CCn1c(N2CCNCC2)nc2cc(C(=O)O)[nH]c(=O)c21.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.46
CHRM1 P11229 2/20 0.44
FAP Q12884 5/20 0.42
DPP9 Q86TI2 1/20 0.39
HRH4 Q9H3N8 1/20 0.36

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 SCHEMBL2961353 0.91 DPP4 (0.44) DPP4CHRM1FAPDPP9HRH4
SCHEMBL6798572 0.87 DPP4 (0.44) DPP4CHRM1FAPDPP9
SCHEMBL13201016 0.84 DPP4 (0.48) DPP4CHRM1FAPDPP9
Trifluoroacetic Acid SCHEMBL2961372 0.83 DPP4 (0.49) DPP4CHRM1FAPDPP9HRH4
Trifluoroacetic Acid SCHEMBL2954627 0.83 DPP4 (0.48) DPP4CHRM1FAPDPP9HRH4
Trifluoroacetic Acid SCHEMBL2966141 0.80 DPP4 (0.48) DPP4CHRM1FAPDPP9
Trifluoroacetic Acid SCHEMBL2965661 0.80 DPP4 (0.54) DPP4CHRM1FAPDPP9
Trifluoroacetic Acid SCHEMBL2960604 0.80 DPP4 (0.52) DPP4CHRM1FAPDPP9
Trifluoroacetic Acid SCHEMBL2957130 0.80 DPP4 (0.55) DPP4CHRM1FAPDPP9
Trifluoroacetic Acid SCHEMBL2964641 0.79 DPP4 (0.52) DPP4CHRM1FAPDPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040116328-A1 Condensed imidazole derivatives EISAI CO., LTD. (JP) 2004-06-17 US disclosed