SCHEMBL2654208

SCHEMBL2654208

COC(=O)c1ccc(CC(C(=O)Nc2nccs2)C2CCOCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 6/20 0.47
▸ LMNA P02545 2/20 0.47
▸ XBP1 P17861 1/20 0.47
▸ PKM P14618 1/20 0.44
▸ RAB9A P51151 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ FFAR2 O15552 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPK1 P28482 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ HSPA1A P0DMV8 1/20 0.39
▸ HSPA5 P11021 1/20 0.39
▸ HSPA9 P38646 1/20 0.39
▸ HSPA2 P54652 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 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
SCHEMBL2659242 0.91 LMNA (0.49) GCKLMNAXBP1PKMRAB9A
SCHEMBL2661212 0.89 GCK (0.48) GCKLMNAXBP1PKMRAB9A
SCHEMBL2661654 0.88 GCK (0.48) GCKLMNAXBP1PKMRAB9A
SCHEMBL2651674 0.88 LMNA (0.46) GCKLMNAXBP1PKMRAB9A
SCHEMBL2662039 0.87 LMNA (0.45) GCKLMNAXBP1PKMRAB9A
SCHEMBL2652650 0.80 LMNA (0.52) GCKLMNARAB9ANPC1ALDH1A1
SCHEMBL2662041 0.80 GCK (0.48) GCKLMNAPKMRAB9ANPC1
SCHEMBL2654206 0.79 GCK (0.73) GCKFFAR2
SCHEMBL2656217 0.74 GCK (0.53) GCKLMNANPC1FFAR2SMN1; SMN2
SCHEMBL2652195 0.74 NPC1 (0.54) LMNAXBP1PKMRAB9ANPC1

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-2168962-A2 PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE MODULATORS Prosidion Limited (GB) 2010-03-31 — — EP disclosed
EP-1594867-A2 PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE MODULATORS Prosidion Limited (GB) 2005-11-16 — — EP disclosed
WO-2004072031-A2 PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE MODULATORS PROSIDION LIMITED (GB) 2004-08-26 — — WO disclosed
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