SCHEMBL24337904

SCHEMBL24337904

CC(C)(C)OC(=O)c1ccc2nc(CN3CCC(c4cccc(Cl)n4)CC3)n(C[C@@H]3CCO3)c2c1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 20/20 0.58
▸ CYP2C8 P10632 2/20 0.53
▸ KCNH2 Q12809 2/20 0.53
▸ HTR1A P08908 1/20 0.53
▸ HTR2A P28223 1/20 0.53

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
SCHEMBL29241200 1.00 GLP1R (0.58) GLP1RCYP2C8KCNH2HTR1AHTR2A
SCHEMBL29491297 1.00 GLP1R (0.58) GLP1RCYP2C8KCNH2HTR1AHTR2A
SCHEMBL30174424 1.00 GLP1R (0.58) GLP1RCYP2C8KCNH2HTR1AHTR2A
SCHEMBL24338535 0.93 GLP1R (0.56) GLP1RCYP2C8KCNH2HTR1A
SCHEMBL24338435 0.93 GLP1R (0.57) GLP1RCYP2C8KCNH2HTR1AHTR2A
SCHEMBL24338646 0.91 GLP1R (0.60) GLP1RCYP2C8KCNH2HTR1AHTR2A
SCHEMBL30903419 0.91 GLP1R (0.60) GLP1RCYP2C8KCNH2HTR1AHTR2A
SCHEMBL30200239 0.91 GLP1R (0.60) GLP1RCYP2C8KCNH2HTR1AHTR2A
SCHEMBL29241307 0.91 GLP1R (0.60) GLP1RCYP2C8KCNH2HTR1AHTR2A
SCHEMBL24338085 0.90 GLP1R (0.61) GLP1RCYP2C8KCNH2HTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115515956-B Benzimidazole derivative, and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2024-06-25 — — CN disclosed
CN-113493447-B GLP-1 receptor agonists 轩竹(北京)医药科技有限公司 2024-06-11 — — CN disclosed
CN-115515956-A Benzimidazole derivative and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2022-12-23 — — CN disclosed
WO-2022068772-A1 BENZIMIDAZOLE DERIVATIVE, AND PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF 深圳信立泰药业股份有限公司 2022-04-07 — — WO disclosed
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