SCHEMBL29945962

SCHEMBL29945962

CC(C)(C)OC(=O)N1CCC(n2ccc(OCc3ccc(C#N)cc3)n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.53
IRAK4 Q9NWZ3 1/20 0.42
JAK2 O60674 1/20 0.42
JAK3 P52333 1/20 0.42
PTK2 Q05397 1/20 0.42
YAP1 P46937 1/20 0.41
TP53 P04637 1/20 0.41
EGLN2 Q96KS0 1/20 0.41
PRMT5 O14744 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
SCHEMBL29946016 0.87 GPR119 (0.46) GPR119TP53
SCHEMBL24265551 0.87 STS (0.48) GPR119JAK2YAP1PRMT5
SCHEMBL29945914 0.87 GPR119 (0.44) GPR119IRAK4EGLN2
SCHEMBL29945930 0.86 GPR119 (0.54) GPR119TP53
SCHEMBL24265672 0.86 GPR119 (0.49) GPR119IRAK4
SCHEMBL29574130 0.86 GPR119 (0.49) GPR119IRAK4
SCHEMBL14636005 0.82 GPR119 (0.50) GPR119TP53
SCHEMBL29945968 0.81 GPR119 (0.44) GPR119
SCHEMBL29946078 0.80 GPR119 (0.49) GPR119EGLN2
SCHEMBL29945954 0.79 KDM1A (0.40)

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