Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8944378

CCCCc1nc2c(C)ccc(OCc3ccccc3)c2n1Cc1ccc(-c2ccccc2C(=O)O)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.55
AGTR2 P50052 3/20 0.54
AGTR1 P30556 2/20 0.54

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
SCHEMBL8395276 0.95 PPARG (0.59) PPARGAGTR2AGTR1
Trifluoroacetic Acid SCHEMBL8391817 0.94 PPARG (0.56) PPARGAGTR2AGTR1
SCHEMBL8944383 0.90 PPARG (0.47) PPARG
Trifluoroacetic Acid SCHEMBL9042949 0.90 AGTR1 (0.43) PPARGAGTR2AGTR1
SCHEMBL8944914 0.89 AGTR2 (0.59) PPARGAGTR2AGTR1
SCHEMBL8944794 0.88 PPARG (0.57) PPARGAGTR2AGTR1
SCHEMBL8392002 0.88 PPARG (0.60) PPARGAGTR2AGTR1
SCHEMBL8391844 0.88 PPARG (0.49) PPARGAGTR2AGTR1
Trifluoroacetic Acid SCHEMBL8391302 0.87 PPARG (0.59) PPARGAGTR2AGTR1
SCHEMBL8396044 0.87 AGTR1 (0.43) AGTR2AGTR1

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-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed