SCHEMBL30428649

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	NPY1R	P25929	2/20	0.68

▸	NPY2R	P49146	2/20	0.68

▸	NPY4R	P50391	2/20	0.68

▸	NPY5R	Q15761	2/20	0.68

▸	GLP1R	P43220	8/20	0.66

▸	KEAP1	Q14145	1/20	0.63

▸	MC4R	P32245	1/20	0.63

▸	MC5R	P33032	1/20	0.63

▸	MC3R	P41968	1/20	0.63

▸	MC1R	Q01726	1/20	0.63

▸	C5AR1	P21730	1/20	0.62

▸	CXCR4	P61073	3/20	0.61

▸	GCGR	P47871	3/20	0.61

▸	PTH1R	Q03431	2/20	0.61

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
SCHEMBL29372759	0.93	NPY2R (0.72)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30432613	0.91	NPY1R (0.69)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30658224	0.91	CXCR4 (0.70)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31182648	0.90	NPY2R (0.72)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL29598077	0.90	NPY2R (0.75)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31683347	0.89	NPY2R (0.71)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30006939	0.89	KEAP1 (0.70)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL29545955	0.89	KEAP1 (0.69)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30439395	0.89	OPRD1 (0.67)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL30775451	0.89	MC4R (0.67)	NPY1RNPY2RNPY4RNPY5RGLP1R

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
US-20230165951-A1	Engineering, production and characterization of plant produced Nucleocapsid and Spike structural proteins of SARS CoV 2 as vaccine candidates against COVID19	MAMEDOV TARLAN (TR)	2023-06-01	—	—	US	disclosed