SCHEMBL31323241

C[C@@H](O)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	SLC6A2	P23975	2/20	0.57

▸	OPRM1	P35372	4/20	0.54

▸	OPRD1	P41143	4/20	0.54

▸	NTSR1	P30989	2/20	0.51

▸	KEAP1	Q14145	2/20	0.51

▸	F2	P00734	4/20	0.50

▸	NTSR2	O95665	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
SCHEMBL31467529	0.87	OPRM1 (0.62)	OPRM1OPRD1KEAP1F2
SCHEMBL14549924	0.86	KEAP1 (0.56)	SLC6A2OPRM1OPRD1KEAP1
SCHEMBL11997748	0.86	KEAP1 (0.56)	SLC6A2OPRM1OPRD1KEAP1
SCHEMBL30163250	0.86	KEAP1 (0.56)	SLC6A2OPRM1OPRD1KEAP1
SCHEMBL30186407	0.84	EPHA2 (0.58)	—
SCHEMBL30061229	0.84	OPRM1 (0.56)	SLC6A2OPRM1OPRD1F2
SCHEMBL31015010	0.84	OPRM1 (0.59)	SLC6A2OPRM1OPRD1KEAP1
SCHEMBL31323238	0.84	KEAP1 (0.58)	OPRM1OPRD1KEAP1
SCHEMBL30163248	0.84	OPRM1 (0.55)	SLC6A2OPRM1OPRD1KEAP1
SCHEMBL29496464	0.83	KEAP1 (0.59)	SLC6A2OPRM1OPRD1KEAP1

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-119280104-A	Tightening anti-wrinkle gel composition with barrier repairing effect and preparation method thereof	中科润航健康科技有限公司	2025-01-10	—	—	CN	disclosed