SCHEMBL29939242

CC(C)C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	CXCR4	P61073	3/20	0.59

▸	KISS1R	Q969F8	13/20	0.56

▸	PTH1R	Q03431	3/20	0.56

▸	GLP1R	P43220	1/20	0.54

▸	GCGR	P47871	1/20	0.54

▸	GIPR	P48546	1/20	0.54

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
SCHEMBL31146271	0.94	ERAP2 (0.57)	CXCR4KISS1R
SCHEMBL30739993	0.93	ERAP2 (0.57)	CXCR4KISS1R
SCHEMBL29486225	0.92	GHSR (0.57)	KISS1R
SCHEMBL31554820	0.92	CXCR4 (0.54)	CXCR4KISS1RPTH1RGLP1RGCGR
SCHEMBL30845352	0.90	KISS1R (0.68)	KISS1R
SCHEMBL31573961	0.90	ERAP2 (0.56)	KISS1R
SCHEMBL29874494	0.90	ERAP2 (0.56)	KISS1R
SCHEMBL31182606	0.90	GLP1R (0.65)	CXCR4PTH1RGLP1RGCGRGIPR
SCHEMBL31484225	0.90	ERAP2 (0.57)	CXCR4KISS1R
SCHEMBL30701867	0.90	IL23R (0.58)	CXCR4PTH1RGLP1RGCGRGIPR

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
CN-115066254-A	Human anti-inflammatory peptides for inhalation treatment of inflammatory lung diseases	阿德维塔生命科学有限责任公司	2022-09-16	—	—	CN	disclosed