SCHEMBL30798191

SCHEMBL30798191

CC(C)(C)OC(=O)N1CC2C=C(c3cccc(OCc4ccc(C#N)cc4F)n3)CC2C1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.43
GLP1R P43220 14/20 0.43
GPR119 Q8TDV5 2/20 0.43
CCNT1 O60563 2/20 0.40
CDK9 P50750 2/20 0.40

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
SCHEMBL30468784 0.84 GPR119 (0.46) PDE10AGLP1RGPR119
SCHEMBL27111251 0.83 GLP1R (0.49) PDE10AGLP1RGPR119
SCHEMBL22391958 0.83 GLP1R (0.47) PDE10AGLP1RGPR119
SCHEMBL29947339 0.83 GLP1R (0.47) PDE10AGLP1RGPR119
SCHEMBL20266521 0.80 GPR119 (0.56) PDE10AGLP1RGPR119
SCHEMBL29556921 0.80 GPR119 (0.56) PDE10AGLP1RGPR119
SCHEMBL27111216 0.79 GPR119 (0.51) PDE10AGLP1RGPR119
SCHEMBL30468789 0.79 GPR119 (0.45) PDE10AGLP1RGPR119
SCHEMBL27111225 0.79 GPR119 (0.56) PDE10AGLP1RGPR119
SCHEMBL22391565 0.79 PDE10A (0.42) PDE10AGLP1RGPR119

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-2024028795-A1 HETEROBICYCLIC COMPOUNDS AS ORAL GLP1R AGONISTS ZYDUS LIFESCIENCES LIMITED (IN) 2024-02-08 WO disclosed