SCHEMBL30512559

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	EPHA2	P29317	2/20	0.55

▸	NPY2R	P49146	7/20	0.53

▸	NPY4R	P50391	7/20	0.53

▸	NPY5R	Q15761	7/20	0.53

▸	NPY1R	P25929	5/20	0.53

▸	MAPK8	P45983	1/20	0.51

▸	MAPK9	P45984	1/20	0.51

▸	MAPK10	P53779	1/20	0.51

▸	NTSR2	O95665	3/20	0.50

▸	NTSR1	P30989	3/20	0.50

▸	AGTR1	P30556	2/20	0.50

▸	SORT1	Q99523	1/20	0.50

▸	EP300	Q09472	1/20	0.50

▸	HIF1A	Q16665	1/20	0.50

▸	RAMP3	O60896	1/20	0.50

▸	CALCR	P30988	1/20	0.50

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
SCHEMBL30974506	0.88	NPY2R (0.58)	EPHA2NPY2RNPY4RNPY5RNPY1R
SCHEMBL30974536	0.88	NPY2R (0.58)	EPHA2NPY2RNPY4RNPY5RNPY1R
SCHEMBL30974466	0.87	NPY2R (0.58)	EPHA2NPY2RNPY4RNPY5RNPY1R
SCHEMBL30974488	0.87	EP300 (0.61)	EPHA2NPY2RNPY4RNPY5RNPY1R
SCHEMBL31005074	0.87	EP300 (0.61)	EPHA2NPY2RNPY4RNPY5RNPY1R
SCHEMBL31005053	0.86	EPHA2 (0.57)	EPHA2NPY2RNPY4RNPY5RNPY1R
SCHEMBL31307255	0.86	EPHA2 (0.58)	EPHA2NPY2RNPY4RNPY5RNPY1R
SCHEMBL31415955	0.85	NTSR1 (0.58)	EPHA2NPY2RNPY4RNPY5RNPY1R
SCHEMBL30435649	0.85	NPY2R (0.68)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL31307232	0.85	EPHA2 (0.56)	EPHA2NPY2RNPY4RNPY5RNPY1R

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