SCHEMBL30588169

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

nearest known ligand 0.43

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	5/20	0.43

▸	SCTR	P47872	1/20	0.43

▸	BACE1	P56817	4/20	0.40

▸	BACE2	Q9Y5Z0	1/20	0.40

▸	KEAP1	Q14145	1/20	0.39

▸	PRMT1	Q99873	1/20	0.39

▸	CALCR	P30988	2/20	0.39

▸	GRPR	P30550	1/20	0.39

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
SCHEMBL30588218	0.99	GLP1R (0.42)	GLP1RSCTRBACE1BACE2KEAP1
SCHEMBL29870812	0.92	GLP1R (0.44)	GLP1RSCTRCALCR
SCHEMBL30974284	0.87	GLP1R (0.46)	GLP1RSCTRKEAP1CALCR
SCHEMBL30476106	0.86	BACE1 (0.49)	BACE1BACE2
SCHEMBL31514360	0.85	PDCD1LG2 (0.37)	BACE1BACE2
SCHEMBL30974417	0.85	GLP1R (0.49)	GLP1RSCTRCALCR
SCHEMBL31757510	0.85	OPRM1 (0.37)	GLP1RSCTRKEAP1PRMT1GRPR
SCHEMBL31189098	0.85	OPRD1 (0.48)	GLP1RSCTRCALCR
SCHEMBL30320554	0.84	BACE1 (0.51)	GLP1RSCTRBACE1BACE2
SCHEMBL31302648	0.84	BACE1 (0.47)	BACE1BACE2

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-116655735-A	Agaricus bisporus umami peptide and prediction and screening method thereof	上海交通大学	2023-08-29	—	—	CN	claimed
CN-116655735-A	Agaricus bisporus umami peptide and prediction and screening method thereof	上海交通大学	2023-08-29	—	—	CN	disclosed