Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9698933

CCCCc1nc2ccc(NC(=O)N3CCCC3)cc2n1Cc1ccc(-c2ccccc2OC(=O)O)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.57
AGTR2 P50052 2/20 0.57

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 SCHEMBL8789098 0.99 AGTR1 (0.56) AGTR1AGTR2
Trifluoroacetic Acid SCHEMBL8790138 0.96 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9039127 0.96 AGTR1 (0.61) AGTR1AGTR2
Trifluoroacetic Acid SCHEMBL9698952 0.93 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9040822 0.90 AGTR1 (0.57) AGTR1AGTR2
Trifluoroacetic Acid SCHEMBL9041973 0.89 AGTR1 (0.56) AGTR1AGTR2
Trifluoroacetic Acid SCHEMBL9096310 0.89 AGTR1 (0.68) AGTR1AGTR2
Trifluoroacetic Acid SCHEMBL8789448 0.89 SPHK1 (0.46) AGTR1AGTR2
SCHEMBL9042345 0.89 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL8792314 0.88 AGTR1 (0.56) AGTR1AGTR2

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
EP-0468470-A1 Benzimidazoles, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-01-29 EP disclosed