SCHEMBL5309290

SCHEMBL5309290

O=Cc1nccc2oc(-c3nc(COC4CCN(C(=O)O)CC4)no3)cc12

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.33
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
TBK1 Q9UHD2 1/20 0.31
SCD O00767 1/20 0.31
SPHK2 Q9NRA0 2/20 0.30
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 1/20 0.30
SPHK1 Q9NYA1 1/20 0.30

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
SCHEMBL392191 0.89 GPR119 (0.47) GPR119TBK1
SCHEMBL5133696 0.88 GPR119 (0.33) GPR119MAPTHTTSPHK2GRIN2D
SCHEMBL1069804 0.87 GPR119 (0.33) GPR119MAPTHTTTBK1SCD
SCHEMBL5304999 0.85 KCNH2 (0.36) GPR119HTTTBK1
SCHEMBL389716 0.79 GPR119 (0.48) GPR119TBK1
SCHEMBL390006 0.77 GPR119 (0.47) GPR119TBK1
SCHEMBL389991 0.77 GPR119 (0.47) GPR119TBK1
SCHEMBL390062 0.77 GPR119 (0.47) GPR119TBK1
SCHEMBL9107919 0.76 CETP (0.38) GPR119
SCHEMBL389862 0.76 GPR119 (0.46) GPR119TBK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1838706-A1 G-PROTEIN COUPLED RECEPTOR AGONISTS Prosidion Limited (GB) 2007-10-03 EP disclosed
WO-2006067532-A1 G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LTD (GB) 2006-06-29 WO disclosed