SCHEMBL31452908

C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	SLC6A2	P23975	1/20	0.57

▸	OPRM1	P35372	2/20	0.52

▸	OPRD1	P41143	1/20	0.51

▸	F2	P00734	1/20	0.51

▸	CALCR	P30988	2/20	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
SCHEMBL29802631	0.94	SLC6A2 (0.60)	SLC6A2OPRM1OPRD1
SCHEMBL30692437	0.88	REN (0.51)	SLC6A2F2
SCHEMBL32665679	0.88	SLC6A2 (0.51)	SLC6A2OPRM1OPRD1F2CALCR
SCHEMBL30233222	0.87	CALCR (0.62)	OPRM1OPRD1F2CALCR
SCHEMBL30512510	0.86	CALCR (0.51)	F2CALCR
SCHEMBL29448041	0.86	SLC6A2 (0.65)	SLC6A2OPRM1OPRD1
SCHEMBL31583875	0.85	NMUR2 (0.54)	SLC6A2F2
SCHEMBL30011313	0.85	CCKBR (0.56)	OPRM1
SCHEMBL30495776	0.85	F2 (0.59)	SLC6A2OPRM1OPRD1F2CALCR
SCHEMBL30729666	0.85	SLC6A2 (0.52)	SLC6A2OPRM1OPRD1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-119751581-A	Cyclic peptide molecule of specific targeting EphA2 and application thereof in preparation of tumor diagnosis reagent or tumor treatment drug	上海交通大学	2025-04-04	—	—	CN	claimed
CN-119751581-A	Cyclic peptide molecule of specific targeting EphA2 and application thereof in preparation of tumor diagnosis reagent or tumor treatment drug	上海交通大学	2025-04-04	—	—	CN	disclosed