SCHEMBL30824296

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.78

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	7/20	0.74

▸	NPY4R	P50391	7/20	0.74

▸	NPY5R	Q15761	7/20	0.74

▸	NPY1R	P25929	5/20	0.74

▸	GLP1R	P43220	6/20	0.71

▸	CXCR4	P61073	5/20	0.67

▸	ECE1	P42892	1/20	0.67

▸	MUS81	Q96NY9	1/20	0.67

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
SCHEMBL30721554	0.96	NPY2R (0.76)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658244	0.95	NPY2R (0.76)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658277	0.94	NPY2R (0.75)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL31182921	0.94	NPY2R (0.76)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658289	0.94	NPY2R (0.73)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL31182522	0.94	NPY2R (0.71)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658333	0.94	NPY2R (0.73)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30494418	0.94	NPY2R (0.67)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30607478	0.93	NPY2R (0.72)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL29679866	0.93	NPY1R (0.72)	NPY2RNPY4RNPY5RNPY1RGLP1R

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