SCHEMBL30512644

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

nearest known ligand 0.56

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	18/20	0.56

▸	NTSR2	O95665	17/20	0.56

▸	SORT1	Q99523	15/20	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
SCHEMBL29823022	0.89	NTSR1 (0.51)	NTSR1NTSR2SORT1
SCHEMBL30525421	0.89	CAPN1 (0.50)	NTSR1NTSR2SORT1
SCHEMBL29655860	0.89	NTSR1 (0.52)	NTSR1NTSR2SORT1
SCHEMBL30512533	0.88	NTSR1 (0.52)	NTSR1NTSR2SORT1
SCHEMBL31174232	0.87	NTSR1 (0.51)	NTSR1NTSR2SORT1
SCHEMBL30577825	0.87	NTSR2 (0.53)	NTSR1NTSR2SORT1
SCHEMBL30390361	0.86	NTSR1 (0.51)	NTSR1NTSR2SORT1
SCHEMBL30512495	0.86	NTSR1 (0.55)	NTSR1NTSR2SORT1
SCHEMBL30767698	0.86	CALCRL (0.51)	NTSR1NTSR2SORT1
SCHEMBL30286598	0.86	NTSR1 (0.50)	NTSR1NTSR2SORT1

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