SCHEMBL30512575

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

nearest known ligand 0.52

Predicted protein targets (top 17)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	7/20	0.49

▸	NPY4R	P50391	7/20	0.49

▸	NPY5R	Q15761	7/20	0.49

▸	NPY1R	P25929	5/20	0.49

▸	KDM1A	O60341	3/20	0.49

▸	MAOB	P27338	1/20	0.49

▸	KDM5A	P29375	1/20	0.49

▸	KDM1B	Q8NB78	1/20	0.49

▸	NTSR2	O95665	2/20	0.48

▸	NTSR1	P30989	2/20	0.48

▸	SORT1	Q99523	2/20	0.48

▸	AGTR1	P30556	1/20	0.47

▸	AGTR2	P50052	1/20	0.47

▸	CALCR	P30988	4/20	0.47

▸	F2	P00734	1/20	0.46

▸	EP300	Q09472	1/20	0.46

▸	HIF1A	Q16665	1/20	0.46

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
SCHEMBL30844247	0.93	NPY2R (0.47)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30844238	0.90	NPY2R (0.50)	NPY2RNPY4RNPY5RNPY1RNTSR2
SCHEMBL30844363	0.90	NPY2R (0.50)	NPY2RNPY4RNPY5RNPY1RNTSR2
SCHEMBL30607428	0.90	CALCR (0.53)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30844335	0.90	NPY2R (0.49)	NPY2RNPY4RNPY5RNPY1RNTSR2
SCHEMBL30150591	0.90	BACE1 (0.51)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL29727004	0.89	AGTR2 (0.47)	NPY2RNPY4RNPY5RNPY1RNTSR2
SCHEMBL29727005	0.89	AGTR2 (0.47)	NPY2RNPY4RNPY5RNPY1RNTSR2
SCHEMBL29823022	0.88	NTSR1 (0.51)	NTSR2NTSR1SORT1
SCHEMBL38664798	0.88	AGTR2 (0.57)	NPY2RNPY4RNPY5RNPY1RKDM1A

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-116490215-A	Targeted mediated endocytic drug delivery	CRM医疗有限公司	2023-07-25	—	—	CN	disclosed