SCHEMBL30512731

CC[C@H](C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)O

nearest known ligand 0.57

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	8/20	0.57

▸	NPY4R	P50391	8/20	0.57

▸	NPY5R	Q15761	8/20	0.57

▸	NPY1R	P25929	6/20	0.57

▸	MAPK8	P45983	1/20	0.55

▸	MAPK9	P45984	1/20	0.55

▸	MAPK10	P53779	1/20	0.55

▸	RAMP3	O60896	8/20	0.53

▸	CALCR	P30988	8/20	0.53

▸	KDM1A	O60341	1/20	0.51

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
SCHEMBL30435678	0.89	NPY2R (0.64)	NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL30338867	0.87	MAPK8 (0.53)	NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL30111261	0.87	NMUR2 (0.54)	NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL30358164	0.87	NPY2R (0.65)	NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL8937058	0.87	NPY2R (0.58)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL8937114	0.87	NPY2R (0.58)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30737634	0.87	MAPK8 (0.57)	NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL30737676	0.87	MAPK8 (0.57)	NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL30567708	0.87	NPY2R (0.61)	NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL31031621	0.86	NPY2R (0.58)	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 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