SCHEMBL31275697

CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	SLC6A2	P23975	1/20	0.59

▸	CMA1	P23946	3/20	0.56

▸	CALCRL	Q16602	4/20	0.56

▸	REN	P00797	2/20	0.56

▸	AGTR1	P30556	1/20	0.55

▸	AGTR2	P50052	1/20	0.55

▸	OPRM1	P35372	2/20	0.52

▸	OPRD1	P41143	2/20	0.52

▸	RAMP1	O60894	1/20	0.52

▸	OPRK1	P41145	1/20	0.51

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
SCHEMBL31206300	0.90	EPHA2 (0.58)	SLC6A2CMA1CALCRLAGTR1AGTR2
SCHEMBL30512666	0.89	AGTR2 (0.55)	SLC6A2RENAGTR1AGTR2OPRM1
SCHEMBL30560036	0.89	OPRD1 (0.60)	RENOPRM1OPRD1
SCHEMBL29579575	0.89	CMA1 (0.58)	SLC6A2CMA1OPRM1OPRD1OPRK1
SCHEMBL30973949	0.88	OPRM1 (0.59)	SLC6A2CMA1OPRM1OPRD1OPRK1
SCHEMBL29746724	0.88	SLC6A2 (0.55)	SLC6A2CMA1OPRM1OPRD1OPRK1
SCHEMBL31362684	0.88	CALCRL (0.60)	SLC6A2CMA1CALCRLRENAGTR1
SCHEMBL32677399	0.88	BACE1 (0.53)	CMA1CALCRLRENAGTR1AGTR2
SCHEMBL29580259	0.87	DPP3 (0.59)	SLC6A2CMA1OPRM1OPRD1OPRK1
SCHEMBL29973755	0.87	DPP3 (0.56)	SLC6A2CMA1RENOPRM1OPRD1

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
JP-2024168267-A	MUSCULAR ATROPHY INHIBITORY COMPOSITION	森永乳業株式会社	2024-12-05	—	—	JP	disclosed