Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL22322849

O=C(O)C[n+]1ccc(-c2cnnc(C(F)(F)F)c2)cc1.O=C([O-])C(F)(F)F

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CHKA P35790 2/20 0.32

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
SCHEMBL22340362 0.94 CHKA (0.34) CHKA
SCHEMBL22340826 0.83 CYP11B1 (0.34) CHKA
Trifluoroacetic Acid SCHEMBL22322813 0.80 WNT3A (0.34) CHKA
SCHEMBL22322851 0.80 CHKA (0.31) CHKA
SCHEMBL22340626 0.78 MAPK1 (0.38) CHKA
Bromide SCHEMBL22322808 0.77 MAPK1 (0.38) CHKA
Trifluoroacetic Acid SCHEMBL23143307 0.71 MAPT (0.33) CHKA
SCHEMBL22340373 0.69 DGAT1 (0.42) CHKA
SCHEMBL11227570 0.69 KDM4E (0.46) —
Trifluoroacetic Acid SCHEMBL23163307 0.68 HAVCR2 (0.46) —

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
WO-2020161162-A1 HERBICIDAL PYRIDINIUM COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 — — WO disclosed
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