SCHEMBL9960422

SCHEMBL9960422

CC(Oc1ccc(OCC(F)(F)F)cn1)(C(=O)Nc1nccs1)c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 17/20 0.44
▸ KCNH2 Q12809 1/20 0.40
▸ EPHX2 P34913 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL2656470 0.91 SCN3A (0.44) GCKKCNH2
SCHEMBL9960421 0.89 GCK (0.43) GCKKCNH2MEN1PKMHTT
SCHEMBL2657686 0.78 GCK (0.47) GCKMEN1KMT2A
SCHEMBL2655672 0.74 BRD4 (0.49) GCKMEN1HTTKMT2A
SCHEMBL2661717 0.73 NR3C1 (0.51) GCK
SCHEMBL27925069 0.67 MEN1 (0.49) MEN1PKMHTTKMT2AHIF1A
SCHEMBL6563302 0.67 GCK (0.55) GCKKCNH2MEN1HTTKMT2A
SCHEMBL2656464 0.66 POLB (0.52) MEN1KMT2A
SCHEMBL28749892 0.66 GCK (0.46) GCKMEN1KMT2A
SCHEMBL17591077 0.65 MEN1 (0.71) MEN1PKMHTTKMT2AHIF1A

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
EP-2125735-B1 2,2,2-TRI-SUBSTITUTED ACETAMIDE DERIVATIVES AS GLUCOKINASE ACTIVATORS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION ADVINUS THERAPEUTICS PRIVATE LTD (IN) 2012-06-27 — — EP claimed
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