Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1656683

CCS(=O)(=O)c1ccc(Oc2cc3nc(-c4ccccn4)[nH]c3cc2Cc2nn[nH]n2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.64

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Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 19/20 0.64

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
SCHEMBL2644297 0.93 GCK (0.71) GCK
Trifluoroacetic Acid SCHEMBL1656618 0.83 GCK (0.75) GCK
SCHEMBL5071857 0.81 GCK (0.78) GCK
Trifluoroacetic Acid SCHEMBL1656538 0.81 GCK (0.74) GCK
SCHEMBL1657701 0.81 GCK (0.82) GCK
SCHEMBL1656395 0.80 GCK (0.79) GCK
SCHEMBL1656688 0.80 GCK (0.81) GCK
SCHEMBL926399 0.80 GCK (0.76) GCK
SCHEMBL1657053 0.79 GCK (0.80) GCK
SCHEMBL1657309 0.79 GCK (0.70) GCK

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-7932394-B2 1-{[5-[4-(Methylsulfonyl)phenoxy]-2-(2-pyridinyl)-1H-benzimidazol-6-yl]methyl}-5-thioxo-2-pyrrolidinone;glucokinase activator; antidiabetic agents; obesity; prevention of retinopathy, nephropathy, neurosis, ischemic cardiopathy, arteriosclerosis; antiischemic agents; cardiotonic agents MSD K.K. (JP) 2011-04-26 — — US disclosed
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