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Sugi Predict / Compounds / SCHEMBL29801807

SCHEMBL29801807

SCHEMBL29801807

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 20/20 0.84

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
SCHEMBL31099271 1.00 GLP1R (0.84) GLP1R
SCHEMBL29431871 1.00 GLP1R (0.84) GLP1R
SCHEMBL29942605 1.00 GLP1R (0.84) GLP1R
SCHEMBL28662518 1.00 GLP1R (0.84) GLP1R
SCHEMBL29349999 0.99 GLP1R (0.84) GLP1R
SCHEMBL31731011 0.98 GLP1R (0.83) GLP1R
SCHEMBL29363146 0.98 GLP1R (0.83) GLP1R
SCHEMBL29362765 0.98 GLP1R (0.83) GLP1R
SCHEMBL29743095 0.98 GLP1R (0.81) GLP1R
SCHEMBL27827907 0.98 GLP1R (0.83) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114807205-B Recombinant engineering bacterium for expressing liraglutide precursor and construction method and application thereof 北京惠之衡生物科技有限公司 2022-09-13 — — CN disclosed
CN-114807205-A Recombinant engineering bacterium for expressing liraglutide precursor and construction method and application thereof 北京惠之衡生物科技有限公司 2022-07-29 — — CN disclosed