SCHEMBL30435305

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

nearest known ligand 0.61

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	7/20	0.61

▸	NTSR2	O95665	6/20	0.61

▸	SORT1	Q99523	4/20	0.61

▸	F2	P00734	2/20	0.58

▸	NPY2R	P49146	6/20	0.56

▸	NPY4R	P50391	6/20	0.56

▸	NPY5R	Q15761	6/20	0.56

▸	NPY1R	P25929	4/20	0.56

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
SCHEMBL30883235	0.93	NPY2R (0.59)	NTSR1NTSR2SORT1F2NPY2R
SCHEMBL30362820	0.92	NTSR1 (0.58)	NTSR1NTSR2SORT1F2NPY2R
SCHEMBL30362990	0.90	NPY2R (0.56)	NTSR1NTSR2SORT1F2NPY2R
SCHEMBL30607402	0.89	NTSR1 (0.66)	NTSR1NTSR2SORT1
SCHEMBL29465928	0.89	NTSR1 (0.60)	NTSR1NTSR2SORT1
SCHEMBL31086923	0.89	NTSR1 (0.60)	NTSR1NTSR2SORT1
SCHEMBL29796754	0.89	NTSR1 (0.60)	NTSR1NTSR2SORT1
SCHEMBL30435444	0.88	OPRD1 (0.67)	NPY2RNPY4RNPY5RNPY1R
SCHEMBL29758902	0.88	NPY2R (0.54)	NTSR1NTSR2SORT1NPY2RNPY4R
SCHEMBL31182965	0.88	CALCR (0.66)	NTSR1NTSR2SORT1NPY2RNPY4R

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
CN-114395545-B	Sialidase for resisting helicobacter pylori colonization in stomach	成都欧林生物科技股份有限公司	2023-05-12	—	—	CN	disclosed