SCHEMBL29823404

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](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](CCCCN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.83

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	20/20	0.83

▸	ECE1	P42892	1/20	0.77

▸	MUS81	Q96NY9	1/20	0.77

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.

Compound	similarity	top predicted	shared targets
SCHEMBL29359146	1.00	GLP1R (0.83)	GLP1RECE1MUS81
SCHEMBL27827907	1.00	GLP1R (0.83)	GLP1RECE1MUS81
SCHEMBL29942457	1.00	GLP1R (0.83)	GLP1RECE1MUS81
SCHEMBL31731011	1.00	GLP1R (0.83)	GLP1RECE1MUS81
SCHEMBL29363146	1.00	GLP1R (0.83)	GLP1RECE1MUS81
SCHEMBL30721588	1.00	GLP1R (0.83)	GLP1RECE1MUS81
SCHEMBL29362765	1.00	GLP1R (0.83)	GLP1RECE1MUS81
SCHEMBL30518507	1.00	GLP1R (0.83)	GLP1RECE1MUS81
SCHEMBL30721547	0.99	GLP1R (0.83)	GLP1R
SCHEMBL31072729	0.99	GLP1R (0.81)	GLP1RECE1MUS81

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-114957443-A	GLP-1 analogs	上海医药工业研究院	2022-08-30	—	—	CN	disclosed