SCHEMBL30648444

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

nearest known ligand 0.53

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	7/20	0.51

▸	NPY4R	P50391	7/20	0.51

▸	NPY5R	Q15761	7/20	0.51

▸	NPY1R	P25929	5/20	0.51

▸	KDM1A	O60341	1/20	0.49

▸	MAOB	P27338	1/20	0.49

▸	KDM5A	P29375	1/20	0.49

▸	KDM1B	Q8NB78	1/20	0.49

▸	TFPI	P10646	4/20	0.49

▸	NTSR2	O95665	1/20	0.49

▸	NTSR1	P30989	1/20	0.49

▸	RAMP3	O60896	3/20	0.47

▸	CALCR	P30988	3/20	0.47

▸	OPRD1	P41143	1/20	0.47

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
SCHEMBL29479866	0.98	NPY2R (0.51)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL29479863	0.97	NPY2R (0.52)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL38662669	0.95	OPRD1 (0.47)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30906558	0.93	RAMP3 (0.47)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30906409	0.93	RAMP3 (0.47)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30997388	0.93	NPY2R (0.54)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL29855903	0.93	NPY2R (0.53)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30930170	0.93	NPY2R (0.54)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30726606	0.93	RAMP3 (0.54)	NPY2RNPY4RNPY5RNPY1RKDM1A
SCHEMBL30930175	0.92	RAMP3 (0.53)	NPY2RNPY4RNPY5RNPY1RRAMP3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-116948034-B	Active type heterophagy antibody blocker Block-5S and preparation method thereof	南京珀尔泰生物技术有限公司	2024-06-25	—	—	CN	disclosed
CN-116948034-A	Active type heterophagy antibody blocker Block-5S and preparation method thereof	南京珀尔泰生物技术有限公司	2023-10-27	—	—	CN	disclosed