SCHEMBL30495798

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

nearest known ligand 0.68

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	NPY1R	P25929	1/20	0.68

▸	NPY2R	P49146	1/20	0.68

▸	NPY4R	P50391	1/20	0.68

▸	NPY5R	Q15761	1/20	0.68

▸	KEAP1	Q14145	1/20	0.65

▸	IL23R	Q5VWK5	2/20	0.64

▸	GLP1R	P43220	7/20	0.64

▸	GCGR	P47871	4/20	0.64

▸	MC4R	P32245	1/20	0.64

▸	MC5R	P33032	1/20	0.64

▸	MC3R	P41968	1/20	0.64

▸	MC1R	Q01726	1/20	0.64

▸	CXCR4	P61073	3/20	0.62

▸	CXCL8	P10145	1/20	0.62

▸	PTH1R	Q03431	2/20	0.61

▸	GIPR	P48546	1/20	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
SCHEMBL30658398	0.94	NPY1R (0.70)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL31182642	0.92	NPY1R (0.73)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31182936	0.92	NPY2R (0.68)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL30519736	0.91	NPY2R (0.73)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL29652635	0.90	NPY1R (0.72)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL29361885	0.90	GLP1R (0.66)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL30432613	0.90	NPY1R (0.69)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL30658408	0.89	GLP1R (0.72)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL30932069	0.89	GLP1R (0.74)	NPY1RNPY2RNPY4RNPY5RKEAP1
SCHEMBL30527868	0.89	GLP1R (0.71)	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-20230190887-A1	TARGETING G3BP AGGREGATION TO PREVENT NEURODEGENERATION	UNIVERSITY OF SOUTH CAROLINA (US)	2023-06-22	—	—	US	disclosed