SCHEMBL30974535

C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CCKBR	P32239	5/20	0.59

▸	OPRD1	P41143	2/20	0.59

▸	CCKAR	P32238	1/20	0.59

▸	NPBWR1	P48145	2/20	0.56

▸	IL23R	Q5VWK5	2/20	0.55

▸	KISS1R	Q969F8	8/20	0.54

▸	CXCR4	P61073	1/20	0.54

▸	PRMT1	Q99873	1/20	0.54

▸	OPRM1	P35372	1/20	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
SCHEMBL30974355	0.93	CCKBR (0.58)	CCKBROPRD1CCKARNPBWR1IL23R
SCHEMBL30974303	0.93	CCKBR (0.61)	CCKBROPRD1CCKARNPBWR1IL23R
SCHEMBL31141448	0.90	KISS1R (0.69)	NPBWR1KISS1R
SCHEMBL31141447	0.89	NPBWR1 (0.66)	CCKBROPRD1CCKARNPBWR1KISS1R
SCHEMBL29705991	0.89	IL23R (0.64)	CCKBRNPBWR1IL23RKISS1R
SCHEMBL30372047	0.88	KISS1R (0.58)	CCKBROPRD1CCKARNPBWR1IL23R
SCHEMBL30974604	0.87	GLP1R (0.63)	CCKBROPRD1CCKARIL23R
SCHEMBL31141460	0.87	KISS1R (0.72)	KISS1R
SCHEMBL29476554	0.86	KISS1R (0.55)	IL23RKISS1R
SCHEMBL23273227	0.86	CCKBR (0.61)	CCKBRCCKARIL23R

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