SCHEMBL29679071

CC[C@H](C)[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 14)

	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

▸	EPHA2	P29317	2/20	0.48

▸	MAPK8	P45983	1/20	0.47

▸	MAPK9	P45984	1/20	0.47

▸	MAPK10	P53779	1/20	0.47

▸	CXCR4	P61073	1/20	0.46

▸	RAMP3	O60896	5/20	0.44

▸	CALCR	P30988	5/20	0.44

▸	EP300	Q09472	1/20	0.44

▸	HIF1A	Q16665	1/20	0.44

▸	NTSR1	P30989	1/20	0.44

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
SCHEMBL29679064	1.00	NPY2R (0.49)	NPY2RNPY4RNPY5RNPY1REPHA2
SCHEMBL29508191	0.93	NPY2R (0.52)	NPY2RNPY4RNPY5RNPY1REPHA2
SCHEMBL31214775	0.91	NPY2R (0.46)	NPY2RNPY4RNPY5RNPY1REPHA2
SCHEMBL30996221	0.91	NPY2R (0.53)	NPY2RNPY4RNPY5RNPY1REPHA2
SCHEMBL29743132	0.88	EPHA2 (0.50)	NPY2RNPY4RNPY5RNPY1REPHA2
SCHEMBL30063864	0.87	NPY2R (0.49)	NPY2RNPY4RNPY5RNPY1REPHA2
SCHEMBL29823436	0.85	EP300 (0.47)	NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL30712901	0.85	NPY2R (0.61)	NPY2RNPY4RNPY5RNPY1RCXCR4
SCHEMBL29743135	0.85	EPHA2 (0.46)	NPY2RNPY4RNPY5RNPY1REPHA2
SCHEMBL31034404	0.85	MAPK8 (0.52)	NPY2RNPY4RNPY5RNPY1RMAPK8

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-110372800-B	Fusion polypeptide with multifunctional activity and application thereof	南京安吉生物科技有限公司	2022-06-07	—	—	CN	disclosed
CN-110372800-B	Fusion polypeptide with multifunctional activity and application thereof	南京安吉生物科技有限公司	2022-06-07	—	—	CN	disclosed