SCHEMBL30224116

CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CAPN1	P07384	2/20	0.64

▸	CTSB	P07858	2/20	0.64

▸	DPP3	Q9NY33	5/20	0.55

▸	CXCR4	P61073	4/20	0.54

▸	NTSR2	O95665	1/20	0.54

▸	NTSR1	P30989	1/20	0.54

▸	SORT1	Q99523	1/20	0.54

▸	KISS1R	Q969F8	4/20	0.52

▸	CXCL8	P10145	3/20	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
SCHEMBL29437939	0.96	CAPN1 (0.60)	CAPN1CTSBDPP3CXCR4NTSR2
SCHEMBL29437937	0.96	CAPN1 (0.63)	CAPN1CTSBDPP3CXCR4NTSR2
SCHEMBL30477480	0.94	CAPN1 (0.65)	CAPN1CTSBDPP3CXCR4NTSR2
SCHEMBL29437935	0.94	DPP3 (0.58)	CAPN1CTSBDPP3CXCR4NTSR2
SCHEMBL29437938	0.90	CAPN1 (0.61)	CAPN1CTSBDPP3CXCR4NTSR2
SCHEMBL29555002	0.88	CAPN1 (0.54)	CAPN1CTSBDPP3CXCR4
SCHEMBL29416081	0.86	DPP3 (0.58)	CAPN1CTSBDPP3CXCR4KISS1R
SCHEMBL30442994	0.86	DPP3 (0.56)	CAPN1CTSBDPP3CXCR4NTSR2
SCHEMBL29713766	0.85	DPP3 (0.63)	CAPN1CTSBDPP3NTSR2NTSR1
SCHEMBL29575470	0.84	DPP3 (0.61)	CAPN1CTSBDPP3NTSR2NTSR1

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
WO-2023013755-A1	CANCER PEPTIDE VACCINE COCKTAIL FORMULATION AMD METHOD FOR PRODUCING SAME	ブライトパス・バイオ株式会社	2023-02-09	—	—	WO	disclosed