SCHEMBL30957173

CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR2	O95665	3/20	0.47

▸	NTSR1	P30989	3/20	0.47

▸	SORT1	Q99523	3/20	0.47

▸	OPRM1	P35372	1/20	0.47

▸	XIAP	P98170	1/20	0.46

▸	F2	P00734	3/20	0.46

▸	NPY2R	P49146	6/20	0.46

▸	NPY4R	P50391	6/20	0.46

▸	NPY5R	Q15761	6/20	0.46

▸	NPY1R	P25929	4/20	0.46

▸	CXCR4	P61073	1/20	0.45

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
SCHEMBL30957171	1.00	NTSR2 (0.47)	NTSR2NTSR1SORT1OPRM1XIAP
SCHEMBL30957175	0.95	XIAP (0.51)	NTSR2NTSR1SORT1XIAPF2
SCHEMBL30481016	0.91	OPRM1 (0.52)	NTSR2NTSR1SORT1OPRM1F2
SCHEMBL30844335	0.89	NPY2R (0.49)	NTSR2NTSR1SORT1OPRM1F2
SCHEMBL30844238	0.87	NPY2R (0.50)	NTSR2NTSR1SORT1F2NPY2R
SCHEMBL30844363	0.87	NPY2R (0.50)	NTSR2NTSR1SORT1F2NPY2R
SCHEMBL31696336	0.86	XIAP (0.47)	NTSR2NTSR1SORT1XIAPF2
SCHEMBL31179920	0.85	NTSR1 (0.51)	NTSR2NTSR1SORT1OPRM1NPY2R
SCHEMBL31415950	0.85	NTSR1 (0.48)	NTSR2NTSR1SORT1OPRM1XIAP
SCHEMBL31676648	0.84	F2 (0.48)	NTSR2NTSR1OPRM1F2

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-118420717-A	Biological fermentation production method of novel small peptide RDPP for promoting plant root system development	南京农业大学	2024-08-02	—	—	CN	disclosed