Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8948194

CCOC(=O)CCN(C(=O)[C@H](CC(=O)NC[C@@H]1CN(C=NN)CCO1)NS(=O)(=O)c1ccc2ccccc2c1)C1CC1.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F2 P00734 14/20 0.46
PLAU P00749 1/20 0.38
PLAT P00750 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
SCHEMBL7308142 0.90 F2 (0.46) F2PLAUPLAT
Trifluoroacetic Acid SCHEMBL8947764 0.87 F2 (0.33) F2
SCHEMBL7306798 0.87 F2 (0.45) F2
SCHEMBL8947782 0.84 F2 (0.35) F2
Hydrochloric Acid SCHEMBL7306153 0.84 F2 (0.55) F2PLAUPLAT
SCHEMBL8947853 0.84 F2 (0.49) F2PLAUPLAT
Hydrochloric Acid SCHEMBL8721887 0.83 F2 (0.46) F2PLAT
Hydrochloric Acid SCHEMBL9168683 0.83 F2 (0.46) F2PLAT
SCHEMBL8947619 0.82 F2 (0.45) F2
SCHEMBL7394423 0.81 BCHE (0.42) F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578594-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1996-11-26 US disclosed
US-5405854-A Anticoagulants HOFFMANN-LA ROCHE INC. (US) 1995-04-11 US disclosed