SCHEMBL30974475

N=C(N)NCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	EPHA2	P29317	5/20	0.57

▸	OPRM1	P35372	4/20	0.56

▸	OPRD1	P41143	4/20	0.56

▸	BDKRB2	P30411	1/20	0.54

▸	F2	P00734	1/20	0.52

▸	NMUR2	Q9GZQ4	3/20	0.50

▸	NMUR1	Q9HB89	3/20	0.50

▸	C5AR1	P21730	1/20	0.48

▸	APLNR	P35414	1/20	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
SCHEMBL30974354	0.94	OPRM1 (0.58)	EPHA2OPRM1OPRD1BDKRB2NMUR2
SCHEMBL30973971	0.92	EPHA2 (0.58)	EPHA2OPRM1OPRD1NMUR2NMUR1
SCHEMBL30782709	0.91	OPRM1 (0.62)	EPHA2OPRM1OPRD1BDKRB2F2
SCHEMBL30974592	0.91	F2 (0.58)	EPHA2OPRM1OPRD1F2
SCHEMBL29934589	0.90	OPRM1 (0.58)	EPHA2OPRM1OPRD1F2
SCHEMBL29608732	0.90	F2 (0.60)	EPHA2OPRM1BDKRB2F2C5AR1
SCHEMBL29554996	0.89	NMUR2 (0.65)	EPHA2OPRM1OPRD1F2NMUR2
SCHEMBL30693083	0.89	F2 (0.58)	EPHA2OPRM1OPRD1BDKRB2F2
SCHEMBL31031584	0.88	OPRM1 (0.60)	OPRM1OPRD1BDKRB2F2
SCHEMBL29406800	0.87	EPHA2 (0.59)	EPHA2OPRM1NMUR2NMUR1

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