SCHEMBL30768184

CSCC[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O

nearest known ligand 0.63

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	5/20	0.63

▸	KEAP1	Q14145	2/20	0.58

▸	NPY1R	P25929	1/20	0.58

▸	NPY2R	P49146	1/20	0.58

▸	NPY4R	P50391	1/20	0.58

▸	NPY5R	Q15761	1/20	0.58

▸	CXCL8	P10145	2/20	0.57

▸	CXCR4	P61073	2/20	0.57

▸	PTH1R	Q03431	1/20	0.56

▸	C5AR1	P21730	1/20	0.56

▸	GLP1R	P43220	3/20	0.55

▸	GCGR	P47871	3/20	0.55

▸	CALCA	P06881	1/20	0.55

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
SCHEMBL29415999	0.90	NPY1R (0.59)	KISS1RKEAP1NPY1RNPY2RNPY4R
SCHEMBL30607323	0.89	GLP1R (0.64)	KEAP1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31182771	0.89	CXCR4 (0.62)	KEAP1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30567307	0.88	NPY1R (0.67)	KEAP1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30519048	0.88	KISS1R (0.60)	KISS1RKEAP1NPY1RNPY2RNPY4R
SCHEMBL30438334	0.88	MAPK8 (0.61)	NPY1RNPY2RNPY4RNPY5R
SCHEMBL29743005	0.88	KEAP1 (0.62)	KEAP1NPY1RNPY2RNPY4RNPY5R
SCHEMBL29416064	0.87	CXCR4 (0.62)	NPY1RNPY2RNPY4RNPY5RCXCL8
SCHEMBL29697149	0.87	CXCR4 (0.65)	NPY1RNPY2RNPY4RNPY5RCXCL8
SCHEMBL30186411	0.86	MC4R (0.66)	KISS1RCXCL8PTH1RC5AR1GLP1R

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-117567584-A	Large yellow croaker antibacterial polypeptide Larimicin and application thereof	厦门大学	2024-02-20	—	—	CN	disclosed