SCHEMBL30199479

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)[C@@H](C)CC)C(C)C)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	NPY1R	P25929	1/20	0.58

▸	NPY2R	P49146	1/20	0.58

▸	NPY4R	P50391	1/20	0.58

▸	NPY5R	Q15761	1/20	0.58

▸	CXCR4	P61073	6/20	0.58

▸	KEAP1	Q14145	2/20	0.57

▸	C5AR1	P21730	1/20	0.57

▸	IL23R	Q5VWK5	1/20	0.57

▸	PTH1R	Q03431	5/20	0.56

▸	MC4R	P32245	1/20	0.56

▸	MC5R	P33032	1/20	0.56

▸	MC3R	P41968	1/20	0.56

▸	MC1R	Q01726	1/20	0.56

▸	KISS1R	Q969F8	2/20	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
SCHEMBL30256968	0.92	NPY1R (0.66)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL30495698	0.90	GLP1R (0.66)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30648457	0.89	C5AR1 (0.69)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30423666	0.89	NPY1R (0.64)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30712904	0.88	CXCR4 (0.68)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL38654334	0.88	NPY2R (0.70)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL30666364	0.88	NPY2R (0.69)	NPY1RNPY2RNPY4RNPY5RIL23R
SCHEMBL29880262	0.88	PTH1R (0.63)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30199009	0.87	MAPK8 (0.59)	KEAP1
SCHEMBL30883203	0.87	NPY1R (0.65)	NPY1RNPY2RNPY4RNPY5RKEAP1

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
EP-4121547-A1	METHODS AND BIOLOGICAL SYSTEMS FOR DISCOVERING AND OPTIMIZING LASSO PEPTIDES	Lassogen, Inc. (US)	2023-01-25	—	—	EP	disclosed