Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2582092

CCCC[C@]1(CC)CS(=O)(=O)c2cc(CCCNCCS(=O)(=O)O)c(OC)cc2[C@@H](c2ccccc2)N1.O=C(O)C(F)(F)F

nearest known ligand 0.91

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 20/20 0.91

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
SCHEMBL14659113 0.95 SLC10A2 (1.00) SLC10A2
Trifluoroacetic Acid SCHEMBL2589845 0.91 SLC10A2 (0.82) SLC10A2
SCHEMBL14659114 0.88 SLC10A2 (0.86) SLC10A2
Trifluoroacetic Acid SCHEMBL2589307 0.88 SLC10A2 (0.89) SLC10A2
SCHEMBL14666335 0.88 SLC10A2 (1.00) SLC10A2
SCHEMBL2595113 0.88 SLC10A2 (1.00) SLC10A2
Ammonia Solution, Strong SCHEMBL2590976 0.88 SLC10A2 (0.98) SLC10A2
Ammonia Solution, Strong SCHEMBL2590972 0.88 SLC10A2 (0.98) SLC10A2
Trifluoroacetic Acid SCHEMBL2589703 0.87 SLC10A2 (0.91) SLC10A2
Trifluoroacetic Acid SCHEMBL2591905 0.86 SLC10A2 (0.90) SLC10A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2563122-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2016-06-08 EP disclosed
EP-2563122-A1 CHEMICAL COMPOUNDS Glaxosmithkline LLC (US) 2013-03-06 EP disclosed
WO-2011137135-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-11-03 WO disclosed