SCHEMBL30974408

C[C@@H](O)[C@H](N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O

nearest known ligand 0.59

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	8/20	0.56

▸	OPRM1	P35372	4/20	0.56

▸	SLC6A2	P23975	1/20	0.52

▸	F2	P00734	1/20	0.52

▸	BDKRB2	P30411	1/20	0.50

▸	ACE	P12821	1/20	0.50

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
SCHEMBL30974525	0.93	OPRM1 (0.55)	OPRD1OPRM1BDKRB2
SCHEMBL30974326	0.92	OPRD1 (0.58)	OPRD1OPRM1SLC6A2F2BDKRB2
SCHEMBL29679769	0.91	OPRD1 (0.56)	OPRD1OPRM1
SCHEMBL30974025	0.87	OPRM1 (0.58)	OPRD1OPRM1
SCHEMBL29679653	0.87	OPRD1 (0.56)	OPRD1OPRM1
SCHEMBL29462069	0.86	OPRD1 (0.65)	OPRD1OPRM1SLC6A2F2
SCHEMBL29679774	0.85	OPRD1 (0.57)	OPRD1OPRM1
SCHEMBL29679908	0.84	OPRD1 (0.57)	OPRD1OPRM1
SCHEMBL29680086	0.84	OPRD1 (0.55)	OPRD1OPRM1F2
SCHEMBL30660761	0.83	SLC6A2 (0.55)	OPRD1OPRM1SLC6A2F2

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
WO-2024132726-A1	SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE	UNIWERSYTET GDANSKI (PL)	2024-06-27	—	—	WO	disclosed