SCHEMBL31223150

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	GRPR	P30550	8/20	0.61

▸	OPRM1	P35372	3/20	0.59

▸	OPRD1	P41143	3/20	0.59

▸	GLP1R	P43220	4/20	0.51

▸	TP53	P04637	1/20	0.49

▸	MDM2	Q00987	1/20	0.49

▸	OPRK1	P41145	1/20	0.49

▸	IL23R	Q5VWK5	1/20	0.49

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
SCHEMBL38661925	0.96	GRPR (0.61)	GRPROPRM1OPRD1GLP1R
SCHEMBL38660507	0.96	GRPR (0.58)	GRPROPRM1OPRD1GLP1R
SCHEMBL29663974	0.95	GRPR (0.68)	GRPROPRM1OPRD1GLP1R
SCHEMBL20764506	0.93	GRPR (0.59)	GRPROPRM1OPRD1GLP1R
SCHEMBL38661265	0.92	GRPR (0.65)	GRPROPRM1OPRD1GLP1R
SCHEMBL30628977	0.92	GRPR (0.64)	GRPRGLP1R
SCHEMBL6510905	0.92	GRPR (0.68)	GRPROPRM1OPRD1GLP1R
SCHEMBL30118089	0.91	GRPR (0.65)	GRPROPRM1OPRD1GLP1R
SCHEMBL31069834	0.91	GRPR (0.66)	GRPRGLP1R
SCHEMBL31494987	0.91	GRPR (0.56)	GRPROPRM1OPRD1

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-119213011-A	Radiolabeled compounds for in vivo imaging of the Gastrin Releasing Peptide Receptor (GRPR) and treatment of GRPR-related disorders	省卫生服务机构	2024-12-27	—	—	CN	disclosed