SCHEMBL30666371

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

nearest known ligand 0.53

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CAPN1	P07384	4/20	0.53

▸	XIAP	P98170	1/20	0.49

▸	CALCRL	Q16602	3/20	0.47

▸	CTSB	P07858	1/20	0.46

▸	NPY2R	P49146	7/20	0.43

▸	NPY4R	P50391	7/20	0.43

▸	NPY5R	Q15761	7/20	0.43

▸	NPY1R	P25929	6/20	0.43

▸	NTSR2	O95665	1/20	0.42

▸	NTSR1	P30989	1/20	0.42

▸	SLC6A2	P23975	1/20	0.42

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
SCHEMBL8937016	0.90	CAPN1 (0.49)	CAPN1XIAPCALCRLNTSR2NTSR1
SCHEMBL8937022	0.90	CAPN1 (0.49)	CAPN1XIAPCALCRLNTSR2NTSR1
SCHEMBL30525445	0.89	CAPN1 (0.53)	CAPN1XIAPCALCRLCTSBSLC6A2
SCHEMBL30525421	0.86	CAPN1 (0.50)	CAPN1NTSR2NTSR1
SCHEMBL30422499	0.85	XIAP (0.55)	XIAPNTSR2NTSR1
SCHEMBL31307285	0.85	CAPN1 (0.53)	CAPN1CTSBNPY2RNPY4RNPY5R
SCHEMBL31235876	0.85	NTSR1 (0.48)	CAPN1XIAPNPY2RNPY4RNPY5R
SCHEMBL30067104	0.84	PTPN1 (0.48)	CAPN1CALCRLNPY2RNPY4RNPY5R
SCHEMBL8936981	0.84	MAPK8 (0.48)	CAPN1
SCHEMBL8936975	0.84	MAPK8 (0.48)	CAPN1

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-117203330-A	Method for culturing dendritic cells	纳米法恩技术有限公司	2023-12-08	—	—	CN	disclosed