SCHEMBL30930552

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	7/20	0.60

▸	NPY4R	P50391	7/20	0.60

▸	NPY5R	Q15761	7/20	0.60

▸	NPY1R	P25929	5/20	0.60

▸	KDM1A	O60341	3/20	0.60

▸	TFPI	P10646	6/20	0.58

▸	MAOB	P27338	1/20	0.57

▸	KDM5A	P29375	1/20	0.57

▸	KDM1B	Q8NB78	1/20	0.57

▸	NTSR2	O95665	2/20	0.57

▸	NTSR1	P30989	2/20	0.57

▸	SORT1	Q99523	2/20	0.57

▸	OPRM1	P35372	1/20	0.56

▸	OPRD1	P41143	1/20	0.56

▸	OPRK1	P41145	1/20	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
SCHEMBL30176462	0.89	NPY2R (0.68)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL31005059	0.88	NPY2R (0.59)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL31031546	0.88	KDM1A (0.67)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30406310	0.88	KDM1A (0.58)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30974100	0.88	TFPI (0.66)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30567696	0.88	CALCR (0.58)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30974098	0.88	NPY2R (0.57)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31005057	0.87	NPY2R (0.59)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL7443144	0.87	KDM1A (0.62)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL31005072	0.87	OPRD1 (0.60)	NPY2RNPY4RNPY5RNPY1RTFPI

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-112029766-B	Application of double-stranded RNA	江苏仁明生物科技有限公司	2024-06-18	—	—	CN	disclosed