SCHEMBL30262215

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

nearest known ligand 0.61

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	4/20	0.55

▸	OPRD1	P41143	4/20	0.55

▸	BACE1	P56817	1/20	0.52

▸	OPRK1	P41145	1/20	0.52

▸	KISS1R	Q969F8	4/20	0.52

▸	OPRL1	P41146	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
SCHEMBL30262051	0.93	BACE1 (0.53)	OPRM1OPRD1BACE1OPRK1KISS1R
SCHEMBL30712895	0.88	OPRM1 (0.60)	OPRM1OPRD1OPRK1KISS1R
SCHEMBL30712876	0.87	OPRM1 (0.54)	OPRM1OPRD1OPRK1KISS1ROPRL1
SCHEMBL30495711	0.86	GLP1R (0.57)	BACE1
SCHEMBL30495638	0.84	BACE1 (0.59)	OPRM1OPRD1BACE1
SCHEMBL30576978	0.84	VIPR1 (0.58)	—
SCHEMBL31073587	0.84	PTH1R (0.55)	BACE1
SCHEMBL30431901	0.83	OPRM1 (0.54)	OPRM1OPRD1BACE1OPRK1
SCHEMBL30320494	0.83	VIPR1 (0.59)	OPRM1OPRD1OPRK1
SCHEMBL29689231	0.82	BACE1 (0.55)	OPRM1OPRD1BACE1OPRK1KISS1R

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
US-20230040544-A1	COMPOSITIONS AND METHODS FOR RESTORING AND MAINTAINING THE DYSTROPHIN-ASSOCIATED PROTEIN COMPLEX (DAPC)	SAREPTA THERAPEUTICS, INC.	2023-02-09	—	—	US	disclosed