Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5044836

CCCCN(CCOC)c1c2c(nn1C)N(c1c(C)cc(C)cc1C)CCC2.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 13/20 0.36

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
SCHEMBL5775051 0.92 CRHR1 (0.41) CRHR1
Trifluoroacetic Acid SCHEMBL5048824 0.88 CRHR1 (0.40) CRHR1
SCHEMBL5776895 0.86 CRHR1 (0.36) CRHR1
Trifluoroacetic Acid SCHEMBL5039148 0.85 PKM (0.33) CRHR1
Trifluoroacetic Acid SCHEMBL5048861 0.84 MAPT (0.34) CRHR1
Trifluoroacetic Acid SCHEMBL5043695 0.84 HTT (0.34) CRHR1
Trifluoroacetic Acid SCHEMBL5039802 0.84 CACNA1B (0.34) CRHR1
SCHEMBL5043842 0.84 CRHR1 (0.41) CRHR1
SCHEMBL5522193 0.83 CRHR1 (0.39) CRHR1
SCHEMBL5047507 0.79 CRHR1 (0.38) CRHR1

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-7432283-B2 Heterocyclic GABAA subtype selective receptor modulators ROCHE PALO ALTO LLC (US) 2008-10-07 US disclosed