Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4753701

Cc1cc(S(=O)(=O)N2C=CNC(=O)[C@H]2CC(=O)N[C@@H]2CCCNCC2)c(C)cc1Cl.O=C(O)C(F)(F)F

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 20/20 0.65

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 SCHEMBL4179700 0.88 BDKRB1 (0.62) BDKRB1
Trifluoroacetic Acid SCHEMBL4179755 0.88 BDKRB1 (0.62) BDKRB1
SCHEMBL4178153 0.83 BDKRB1 (0.69) BDKRB1
SCHEMBL4178148 0.83 BDKRB1 (0.69) BDKRB1
SCHEMBL4180634 0.79 BDKRB1 (1.00) BDKRB1
SCHEMBL4179696 0.79 BDKRB1 (1.00) BDKRB1
SCHEMBL4753707 0.79 BDKRB1 (0.47) BDKRB1
Trifluoroacetic Acid SCHEMBL4172331 0.78 BDKRB1 (0.79) BDKRB1
SCHEMBL4169688 0.77 BDKRB1 (0.93) BDKRB1
SCHEMBL4168628 0.77 BDKRB1 (0.93) BDKRB1

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-1963285-A1 BRADYKININ 1 RECEPTOR ANTAGONISTS Amgen Inc. (US) 2008-09-03 EP claimed
WO-2007067629-A1 BRADYKININ 1 RECEPTOR ANTAGONISTS AMGEN INC. (US) 2007-06-14 WO claimed
EP-1963285-A1 BRADYKININ 1 RECEPTOR ANTAGONISTS Amgen Inc. (US) 2008-09-03 EP disclosed
WO-2007067629-A1 BRADYKININ 1 RECEPTOR ANTAGONISTS AMGEN INC. (US) 2007-06-14 WO disclosed