SCHEMBL5140785

SCHEMBL5140785

COCC[AsH]c1ccc(-n2ncc3c(OC4CCN(C(=O)OC(C)C)CC4)ncnc32)cc1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.69
CYP2C9 P11712 1/20 0.56
KCNH2 Q12809 1/20 0.56
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL390792 0.86 GPR119 (0.69) GPR119CYP2C9KCNH2NPC1RAB9A
SCHEMBL390682 0.84 GPR119 (0.79) GPR119CYP2C9KCNH2
SCHEMBL388204 0.84 GPR119 (0.79) GPR119CYP2C9KCNH2
SCHEMBL388652 0.82 GPR119 (0.76) GPR119CYP2C9KCNH2NPC1
SCHEMBL386623 0.82 GPR119 (0.76) GPR119CYP2C9KCNH2
SCHEMBL388759 0.82 GPR119 (1.00) GPR119CYP2C9KCNH2
SCHEMBL391165 0.81 GPR119 (0.71) GPR119CYP2C9KCNH2NPC1ALDH1A1
SCHEMBL27747879 0.79 GPR119 (0.82) GPR119CYP2C9KCNH2
SCHEMBL389668 0.78 GPR119 (0.74) GPR119CYP2C9KCNH2
SCHEMBL386467 0.78 GPR119 (0.74) GPR119CYP2C9KCNH2

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-2004157-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AS WELL AS COMBINATION THERAPY RELATING THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-24 EP disclosed
WO-2007120702-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AND COMBINATION THERAPY RELATING THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO disclosed