SCHEMBL30454077

SCHEMBL30454077

Fc1ccc(COc2cccc(C3=CCN(CC4C=CC=C[C@@H]4CC4CCO4)CC3)n2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 20/20 0.49
▸ CYP2C8 P10632 2/20 0.38
▸ KCNH2 Q12809 2/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ HTR2A P28223 1/20 0.38

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
SCHEMBL30454569 0.93 GLP1R (0.50) GLP1R
SCHEMBL30453956 0.91 GLP1R (0.55) GLP1RCYP2C8KCNH2HTR1A
SCHEMBL30454376 0.83 GLP1R (0.34) GLP1RHTR1A
SCHEMBL29559346 0.81 GLP1R (0.41) GLP1RCYP2C8KCNH2HTR1A
SCHEMBL30455033 0.81 GLP1R (0.42) GLP1R
SCHEMBL29559363 0.79 GLP1R (0.39) GLP1RCYP2C8KCNH2HTR1A
SCHEMBL30454330 0.78 DRD4 (0.37) KCNH2HTR1A
SCHEMBL30284281 0.77 GLP1R (0.39) GLP1R
SCHEMBL30200446 0.75 DRD4 (0.36) GLP1R
SCHEMBL22391889 0.75 GLP1R (0.77) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113227068-B GLP-1R agonists and uses thereof 上海齐鲁锐格医药研发有限公司 2023-06-13 — — CN disclosed
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