SCHEMBL30094362

CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	SLC6A2	P23975	1/20	0.54

▸	REN	P00797	2/20	0.51

▸	NMUR2	Q9GZQ4	2/20	0.50

▸	OPRM1	P35372	2/20	0.49

▸	OPRD1	P41143	2/20	0.49

▸	NMUR1	Q9HB89	1/20	0.49

▸	CXCL8	P10145	2/20	0.48

▸	CMA1	P23946	1/20	0.48

▸	OPRK1	P41145	1/20	0.48

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
SCHEMBL29616319	0.94	SLC6A2 (0.53)	SLC6A2RENNMUR2OPRM1OPRD1
SCHEMBL30059638	0.94	SLC6A2 (0.63)	SLC6A2RENCMA1
SCHEMBL30412382	0.89	OPRM1 (0.54)	SLC6A2RENOPRM1OPRD1CXCL8
SCHEMBL29588428	0.89	SLC6A2 (0.55)	SLC6A2RENNMUR2OPRM1OPRD1
SCHEMBL30974085	0.88	NTSR1 (0.53)	SLC6A2CXCL8
SCHEMBL31548690	0.88	CALCRL (0.58)	SLC6A2
SCHEMBL29531518	0.87	SLC6A2 (0.55)	SLC6A2RENOPRM1OPRD1CMA1
SCHEMBL8142396	0.87	BACE1 (0.49)	RENOPRK1
SCHEMBL31694455	0.87	SLC6A2 (0.58)	SLC6A2RENOPRM1OPRD1OPRK1
SCHEMBL29489418	0.87	SLC6A2 (0.65)	SLC6A2RENOPRM1OPRD1OPRK1

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-114469773-B	Stable anti-aging composition, preparation and application thereof	广东圣雪颜生物科技有限公司	2022-12-06	—	—	CN	disclosed