SCHEMBL30495635

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC

nearest known ligand 0.66

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	8/20	0.66

▸	NPY4R	P50391	8/20	0.66

▸	NPY5R	Q15761	8/20	0.66

▸	NPY1R	P25929	6/20	0.66

▸	CALCR	P30988	4/20	0.64

▸	F2	P00734	4/20	0.61

▸	GLP1R	P43220	2/20	0.61

▸	GCGR	P47871	1/20	0.61

▸	GIPR	P48546	1/20	0.61

▸	HCRTR1	O43613	1/20	0.59

▸	HCRTR2	O43614	1/20	0.59

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
SCHEMBL31182767	0.93	CALCR (0.67)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30974242	0.93	CALCR (0.62)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30431782	0.91	CALCR (0.65)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30444134	0.91	APLNR (0.63)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30432875	0.91	CALCR (0.65)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29767747	0.91	CALCR (0.64)	NPY2RNPY1RCALCRF2GLP1R
SCHEMBL30511771	0.90	CALCR (0.67)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30567015	0.90	CALCR (0.67)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30537477	0.90	NPY2R (0.65)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31005061	0.90	CALCR (0.62)	NPY2RNPY4RNPY5RNPY1RCALCR

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