SCHEMBL31683330

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	NPY1R	P25929	1/20	0.65

▸	NPY2R	P49146	1/20	0.65

▸	NPY4R	P50391	1/20	0.65

▸	NPY5R	Q15761	1/20	0.65

▸	CXCR4	P61073	3/20	0.62

▸	KEAP1	Q14145	1/20	0.61

▸	GLP1R	P43220	5/20	0.60

▸	F2	P00734	3/20	0.59

▸	CXCL8	P10145	1/20	0.59

▸	ECE1	P42892	1/20	0.59

▸	MUS81	Q96NY9	1/20	0.59

▸	PTH1R	Q03431	4/20	0.59

▸	EP300	Q09472	1/20	0.58

▸	HIF1A	Q16665	1/20	0.58

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
SCHEMBL31688313	0.93	NPY1R (0.63)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL31688327	0.90	F2 (0.58)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30358170	0.90	NPY2R (0.72)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30658277	0.89	NPY2R (0.75)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30658333	0.89	NPY2R (0.73)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30712911	0.89	NPY1R (0.61)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL31683320	0.89	NPY2R (0.73)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30658385	0.88	NPY1R (0.69)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL29430200	0.88	NPY2R (0.74)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30887976	0.88	KEAP1 (0.69)	CXCR4KEAP1GLP1RCXCL8PTH1R

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-20250283037-A1	METHODS FOR STIMULATING AND TRANSDUCING T CELLS	JUNO THERAPEUTICS GMBH (DE)	2025-09-11	—	—	US	disclosed