SCHEMBL31015010

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

nearest known ligand 0.59

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	4/20	0.59

▸	OPRD1	P41143	4/20	0.59

▸	SLC6A2	P23975	1/20	0.57

▸	KEAP1	Q14145	3/20	0.55

▸	CALCRL	Q16602	5/20	0.55

▸	RAMP1	O60894	1/20	0.51

▸	EPHA2	P29317	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
SCHEMBL31014868	0.87	CALCR (0.62)	OPRM1OPRD1KEAP1
SCHEMBL31575685	0.87	CALCRL (0.56)	OPRM1OPRD1SLC6A2KEAP1CALCRL
SCHEMBL31000872	0.85	CALCR (0.60)	OPRM1OPRD1KEAP1
SCHEMBL31388233	0.85	KEAP1 (0.60)	OPRM1OPRD1SLC6A2KEAP1
SCHEMBL29392890	0.84	CALCRL (0.56)	OPRM1OPRD1KEAP1CALCRLRAMP1
SCHEMBL30186556	0.84	CALCRL (0.55)	OPRM1OPRD1KEAP1CALCRLRAMP1
SCHEMBL30495622	0.84	OPRM1 (0.57)	OPRM1OPRD1SLC6A2KEAP1CALCRL
SCHEMBL30277946	0.84	CALCR (0.60)	KEAP1CALCRLEPHA2
SCHEMBL31323241	0.84	SLC6A2 (0.57)	OPRM1OPRD1SLC6A2KEAP1
SCHEMBL29392324	0.84	KEAP1 (0.51)	OPRM1OPRD1KEAP1CALCRLRAMP1

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-118496322-A	Polypeptide inhibitor for targeted degradation of beta-catenin and application thereof	昆明医科大学	2024-08-16	—	—	CN	disclosed