SCHEMBL29103527

SCHEMBL29103527

COC(=O)c1ccc2nc(CN3CCNCC3)n(CC3CCO3)c2c1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 20/20 0.50
▸ HTR1A P08908 1/20 0.47
▸ CYP2C8 P10632 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47

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
SCHEMBL29826354 1.00 GLP1R (0.50) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29103523 1.00 GLP1R (0.50) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL25089759 0.92 GLP1R (0.51) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL24791812 0.92 GLP1R (0.51) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL27477879 0.91 GLP1R (0.50) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL25089540 0.89 GLP1R (0.58) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29103599 0.89 GLP1R (0.58) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL29826147 0.89 GLP1R (0.58) GLP1RHTR1ACYP2C8KCNH2
SCHEMBL22402435 0.87 GLP1R (0.43) GLP1R
SCHEMBL30899101 0.87 GLP1R (0.43) GLP1R

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117177970-A Polycyclic derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-12-05 — — CN disclosed
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
WO-2022228490-A1 POLYCYCLIC DERIVATIVE MODULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2022-11-03 — — WO disclosed
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