Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3902136

N=C(N)c1ccc(CC(=O)C(=O)O)c(OCCNC(=O)c2ccc(N3CCCC3)cc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.74
F2 P00734 3/20 0.74
PPARG P37231 4/20 0.40
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38

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
SCHEMBL14132218 0.96 F10 (0.80) F10F2PPARGITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL3905673 0.90 F10 (0.92) F10F2
SCHEMBL3902149 0.88 F10 (0.62) F10F2PPARG
SCHEMBL13901249 0.85 F10 (1.00) F10F2ITGB3ITGA2B
SCHEMBL14132315 0.84 F10 (1.00) F10F2ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL3899621 0.83 F10 (0.75) F10F2
Trifluoroacetic Acid SCHEMBL3897265 0.83 F10 (0.75) F10F2
Trifluoroacetic Acid SCHEMBL6865355 0.82 F10 (0.64) F10F2
Trifluoroacetic Acid SCHEMBL3911489 0.82 F10 (0.92) F10F2ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL3896204 0.81 F10 (0.70) F10F2ITGB3ITGA2B

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
EP-0976722-B1 BENZAMIDINE DERIVATIVES AJINOMOTO KK (JP) 2009-03-11 EP disclosed
US-7396844-B1 Benzamidine derivatives AJINOMOTO CO., INC. (JP) 2008-07-08 US disclosed
EP-0976722-A1 BENZAMIDINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2000-02-02 EP disclosed