SCHEMBL29945930

SCHEMBL29945930

CC(C)(C)OC(=O)N1CCC(n2ccc(OCc3ccncc3)n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.54
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
NAMPT P43490 1/20 0.43
SLC2A1 P11166 1/20 0.42
TP53 P04637 1/20 0.41

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
SCHEMBL24265551 0.91 STS (0.48) GPR119
SCHEMBL29946016 0.89 GPR119 (0.46) GPR119TP53
SCHEMBL29945962 0.86 GPR119 (0.53) GPR119TP53
SCHEMBL14636005 0.85 GPR119 (0.50) GPR119TP53
SCHEMBL29946022 0.81 NR3C1 (0.44) GPR119TP53
SCHEMBL29946041 0.80 GPR119 (0.45) GPR119TP53
SCHEMBL29945877 0.78 GPR119 (0.43) GPR119TP53
SCHEMBL1557907 0.78 CTSD (0.49) GPR119
SCHEMBL29946050 0.78 GPR119 (0.50) GPR119
SCHEMBL1582522 0.78 GPR119 (0.47) GPR119

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
WO-2022184849-A1 GLP-1R AGONISTS, USES AND PHARMACEUTICAL COMPOSITIONS THEREOF LES LABORATOIRES SERVIER (FR) 2022-09-09 WO disclosed