SCHEMBL29103499

SCHEMBL29103499

COC(=O)c1ccc2nc(CN3CCN(C(=O)c4cccc(Oc5ccc(C(C)C)cc5C)c4)CC3)n(C[C@@H]3CCO3)c2c1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 19/20 0.44
▸ HTR1A P08908 1/20 0.41
▸ CYP2C8 P10632 1/20 0.41
▸ KCNH2 Q12809 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
SCHEMBL30199994 1.00 GLP1R (0.44) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29103501 1.00 GLP1R (0.44) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29103493 0.93 GLP1R (0.51) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29103488 0.93 GLP1R (0.51) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29826161 0.93 GLP1R (0.51) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL30199768 0.88 GLP1R (0.44) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL30199349 0.85 GLP1R (0.52) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29103515 0.84 GLP1R (0.53) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29826418 0.84 GLP1R (0.53) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29103508 0.84 GLP1R (0.53) GLP1RHTR1ACYP2C8KCNH2

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
CN-117043154-A GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof 卡莫特医疗有限公司 2023-11-10 — — CN disclosed
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