SCHEMBL30745365

SCHEMBL30745365

COC(=O)c1ccc2nc(CN3CCC(c4cccc(Oc5ccccc5)c4)C3)n(C[C@@H]3CCO3)c2c1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 20/20 0.51
▸ CYP2C8 P10632 1/20 0.49
▸ HTR2A P28223 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49

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
SCHEMBL24792581 1.00 GLP1R (0.51) GLP1RCYP2C8HTR2AKCNH2
SCHEMBL29157103 0.92 GLP1R (0.56) GLP1RCYP2C8HTR2AKCNH2
SCHEMBL30053945 0.92 GLP1R (0.56) GLP1RCYP2C8HTR2AKCNH2
SCHEMBL24792547 0.92 GLP1R (0.56) GLP1RCYP2C8HTR2AKCNH2
SCHEMBL24793024 0.88 GLP1R (0.51) GLP1RCYP2C8HTR2AKCNH2
SCHEMBL24793829 0.88 GLP1R (0.51) GLP1RCYP2C8HTR2AKCNH2
SCHEMBL29157086 0.88 GLP1R (0.51) GLP1RCYP2C8HTR2AKCNH2
SCHEMBL27191387 0.85 GLP1R (0.56) GLP1RCYP2C8HTR2AKCNH2
SCHEMBL24791693 0.83 GLP1R (0.53) GLP1R
SCHEMBL30745416 0.83 GLP1R (0.53) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117545748-A Benzimidazolyl GLP-1GPCR receptor agonists, pharmaceutical compositions comprising the same, and methods of use thereof 卡莫特医疗有限公司 2024-02-09 — — CN disclosed
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