SCHEMBL30768183

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	15/20	0.53

▸	CTSD	P07339	4/20	0.51

▸	TFPI	P10646	1/20	0.49

▸	NPY4R	P50391	4/20	0.49

▸	NPY1R	P25929	3/20	0.49

▸	NPY2R	P49146	2/20	0.49

▸	NPY5R	Q15761	2/20	0.49

▸	BACE2	Q9Y5Z0	1/20	0.47

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
SCHEMBL30262050	0.92	TFPI (0.50)	BACE1CTSDTFPIBACE2
SCHEMBL29625167	0.92	NPY4R (0.49)	BACE1CTSDTFPINPY4RNPY1R
SCHEMBL31461994	0.92	NPY4R (0.49)	BACE1CTSDNPY4RNPY1RNPY2R
SCHEMBL30973947	0.91	NPY4R (0.56)	BACE1CTSDNPY4RNPY1RNPY2R
SCHEMBL30692435	0.91	TFPI (0.47)	BACE1TFPINPY4RNPY1RNPY2R
SCHEMBL29679733	0.90	BACE1 (0.54)	BACE1CTSDTFPINPY4RNPY1R
SCHEMBL29696019	0.90	NPY4R (0.49)	BACE1CTSDTFPINPY4RNPY1R
SCHEMBL29886924	0.90	BACE1 (0.51)	BACE1CTSDNPY4RNPY1RNPY2R
SCHEMBL30605187	0.90	TFPI (0.52)	BACE1CTSDTFPI
SCHEMBL30659913	0.90	NPY4R (0.53)	BACE1CTSDNPY4RNPY1RNPY2R

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-117567584-A	Large yellow croaker antibacterial polypeptide Larimicin and application thereof	厦门大学	2024-02-20	—	—	CN	disclosed