SCHEMBL30824294

CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O

nearest known ligand 0.68

Predicted protein targets (top 9)

	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	0.60

▸	OPRM1	P35372	2/20	0.60

▸	OPRD1	P41143	2/20	0.60

▸	OPRK1	P41145	2/20	0.60

▸	NTSR1	P30989	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
SCHEMBL30607331	0.91	NPY2R (0.69)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30435444	0.91	OPRD1 (0.67)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30429255	0.90	CALCR (0.66)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31000890	0.89	NPY2R (0.63)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30607403	0.89	CALCR (0.67)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31000874	0.89	NPY2R (0.64)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30495626	0.89	NPY2R (0.68)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30906483	0.89	NPY2R (0.63)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30712938	0.89	CALCR (0.68)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30495647	0.89	NPY2R (0.77)	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-11925667-B2	Engineered therapeutic probiotic system and method	CHANG MATTHEW WOOK (SG)	2024-03-12	—	—	US	disclosed