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Sugi Predict / Compounds / SCHEMBL30576555

SCHEMBL30576555

SCHEMBL30576555

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 20/20 0.67
▸ SCTR P47872 1/20 0.67

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
SCHEMBL30576560 0.98 GLP1R (0.66) GLP1RSCTR
SCHEMBL30656876 0.95 GLP1R (0.61) GLP1RSCTR
SCHEMBL30656877 0.95 GLP1R (0.61) GLP1RSCTR
SCHEMBL29462130 0.94 GLP1R (0.75) GLP1RSCTR
SCHEMBL30428145 0.94 GLP1R (0.75) GLP1RSCTR
SCHEMBL29800085 0.94 GLP1R (0.75) GLP1RSCTR
SCHEMBL30377709 0.94 GLP1R (0.75) GLP1RSCTR
SCHEMBL30377221 0.94 GLP1R (0.75) GLP1RSCTR
SCHEMBL31406266 0.94 GLP1R (0.75) GLP1RSCTR
SCHEMBL29800188 0.94 GLP1R (0.75) GLP1RSCTR

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-112608378-B GLP-1/cholecystokinin-1 receptor dual agonist and application thereof 江苏师范大学 2023-09-08 — — CN claimed
CN-112759640-B GLP-1/gastrin receptor dual agonist and application thereof 江苏师范大学 2023-09-08 — — CN disclosed
CN-112608378-B GLP-1/cholecystokinin-1 receptor dual agonist and application thereof 江苏师范大学 2023-09-08 — — CN disclosed
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