SCHEMBL30974093

C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	EPHA2	P29317	2/20	0.60

▸	CALCRL	Q16602	5/20	0.59

▸	RAMP1	O60894	1/20	0.59

▸	RAMP3	O60896	1/20	0.54

▸	CALCR	P30988	1/20	0.54

▸	NMUR2	Q9GZQ4	2/20	0.54

▸	NMUR1	Q9HB89	2/20	0.54

▸	OPRM1	P35372	1/20	0.54

▸	OPRD1	P41143	1/20	0.54

▸	TFPI	P10646	2/20	0.53

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
SCHEMBL30974124	0.96	EPHA2 (0.60)	EPHA2CALCRLRAMP1RAMP3CALCR
SCHEMBL31005053	0.95	EPHA2 (0.57)	EPHA2CALCRLRAMP1
SCHEMBL30974204	0.95	EPHA2 (0.57)	EPHA2CALCRLRAMP1
SCHEMBL30973990	0.94	EPHA2 (0.60)	EPHA2CALCRLRAMP1RAMP3CALCR
SCHEMBL30974050	0.93	EPHA2 (0.58)	EPHA2RAMP3CALCRNMUR2NMUR1
SCHEMBL30974488	0.91	EP300 (0.61)	EPHA2CALCRLRAMP1TFPI
SCHEMBL31005074	0.91	EP300 (0.61)	EPHA2CALCRLRAMP1TFPI
SCHEMBL30974536	0.90	NPY2R (0.58)	EPHA2CALCRLRAMP1TFPI
SCHEMBL30974506	0.90	NPY2R (0.58)	EPHA2CALCRLRAMP1TFPI
SCHEMBL30974466	0.90	NPY2R (0.58)	EPHA2RAMP3CALCRNMUR2NMUR1

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	claimed