SCHEMBL29638285

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	LNPEP	Q9UIQ6	5/20	0.62

▸	ANPEP	P15144	3/20	0.62

▸	REN	P00797	4/20	0.61

▸	NTSR2	O95665	10/20	0.56

▸	NTSR1	P30989	10/20	0.56

▸	SORT1	Q99523	9/20	0.55

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
SCHEMBL29638302	0.97	REN (0.62)	LNPEPANPEPRENNTSR2NTSR1
SCHEMBL29638299	0.95	LNPEP (0.63)	LNPEPANPEPRENNTSR2NTSR1
SCHEMBL29638298	0.93	LNPEP (0.62)	LNPEPANPEPRENNTSR2NTSR1
SCHEMBL29638290	0.91	LNPEP (0.56)	LNPEPANPEPREN
SCHEMBL29638293	0.90	LNPEP (0.63)	LNPEPANPEPRENNTSR2NTSR1
SCHEMBL29638282	0.90	LNPEP (0.68)	LNPEPANPEPREN
SCHEMBL29638278	0.89	REN (0.61)	LNPEPANPEPRENNTSR2NTSR1
SCHEMBL29392664	0.89	LNPEP (0.65)	LNPEPANPEPRENNTSR2NTSR1
SCHEMBL29638288	0.88	DPP3 (0.58)	LNPEPANPEPREN
SCHEMBL29638291	0.87	LNPEP (0.66)	LNPEPANPEPREN

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-109400683-B	Antitumor cyclic peptide and preparation method and application thereof	安徽工程大学	2022-05-17	—	—	CN	disclosed