SCHEMBL30974466

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	8/20	0.58

▸	NPY4R	P50391	8/20	0.58

▸	NPY5R	Q15761	8/20	0.58

▸	NPY1R	P25929	8/20	0.58

▸	EP300	Q09472	1/20	0.55

▸	HIF1A	Q16665	1/20	0.55

▸	RAMP3	O60896	1/20	0.54

▸	CALCR	P30988	1/20	0.54

▸	EPHA2	P29317	2/20	0.54

▸	MAPK8	P45983	1/20	0.54

▸	MAPK9	P45984	1/20	0.54

▸	MAPK10	P53779	1/20	0.54

▸	NMUR2	Q9GZQ4	2/20	0.51

▸	NMUR1	Q9HB89	2/20	0.51

▸	TFPI	P10646	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
SCHEMBL31005063	0.96	NPY2R (0.62)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL31005056	0.96	NPY2R (0.64)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30974536	0.95	NPY2R (0.58)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30974506	0.95	NPY2R (0.58)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30974204	0.95	EPHA2 (0.57)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL31005053	0.95	EPHA2 (0.57)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30974050	0.94	EPHA2 (0.58)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL31005074	0.92	EP300 (0.61)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30974488	0.92	EP300 (0.61)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30973990	0.90	EPHA2 (0.60)	NPY2RNPY4RNPY5RNPY1RRAMP3

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