SCHEMBL30495698

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

nearest known ligand 0.69

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	6/20	0.66

▸	RXFP1	Q9HBX9	1/20	0.66

▸	NPY1R	P25929	1/20	0.66

▸	NPY2R	P49146	1/20	0.66

▸	NPY4R	P50391	1/20	0.66

▸	NPY5R	Q15761	1/20	0.66

▸	KEAP1	Q14145	1/20	0.65

▸	CXCR4	P61073	1/20	0.65

▸	PTH1R	Q03431	8/20	0.64

▸	GCGR	P47871	1/20	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
SCHEMBL31182766	0.94	PTH1R (0.73)	GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30495604	0.93	GLP1R (0.71)	GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL31622297	0.92	KEAP1 (0.68)	GLP1RRXFP1NPY1RNPY2RNPY4R
SCHEMBL30006939	0.92	KEAP1 (0.70)	GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL29545955	0.92	KEAP1 (0.69)	GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30658214	0.92	NPY2R (0.72)	GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30775451	0.91	MC4R (0.67)	GLP1RRXFP1NPY1RNPY2RNPY4R
SCHEMBL30658259	0.91	NPY2R (0.70)	GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL31182694	0.91	CXCR4 (0.71)	GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL31182648	0.90	NPY2R (0.72)	GLP1RNPY1RNPY2RNPY4RNPY5R

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