SCHEMBL29794159

CSCC[C@@H](N)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](C)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(=O)N[C@H](C)C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	10/20	0.59

▸	OPRM1	P35372	6/20	0.53

▸	OPRK1	P41145	1/20	0.53

▸	BACE1	P56817	2/20	0.50

▸	BACE2	Q9Y5Z0	2/20	0.50

▸	CASP1	P29466	1/20	0.49

▸	FNTA	P49354	2/20	0.48

▸	FNTB	P49356	2/20	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
SCHEMBL29794173	0.95	OPRD1 (0.61)	OPRD1OPRM1OPRK1BACE1CASP1
SCHEMBL29794150	0.90	OPRD1 (0.70)	OPRD1OPRM1OPRK1CASP1
SCHEMBL30773655	0.89	OPRD1 (0.51)	OPRD1OPRM1OPRK1BACE1BACE2
SCHEMBL29527337	0.87	OPRD1 (0.51)	OPRD1OPRM1OPRK1FNTAFNTB
SCHEMBL29534731	0.86	OPRD1 (0.54)	OPRD1OPRM1OPRK1FNTAFNTB
SCHEMBL29794105	0.86	OPRD1 (0.59)	OPRD1OPRM1OPRK1
SCHEMBL30829448	0.84	FNTA (0.53)	OPRD1OPRM1FNTAFNTB
SCHEMBL30465912	0.84	FNTA (0.62)	BACE1BACE2FNTAFNTB
SCHEMBL29794175	0.84	OPRD1 (0.53)	OPRD1OPRM1OPRK1BACE1BACE2
SCHEMBL1373294	0.83	OPRD1 (0.62)	OPRD1OPRM1OPRK1BACE1BACE2

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
EP-4041748-A1	PEPTIDE COMPOUNDS FOR REDUCING SIDE EFFECTS OF CB1 RECEPTOR AGONISTS	Universitat de Barcelona (ES)	2022-08-17	—	—	EP	claimed