SCHEMBL31484240

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

nearest known ligand 0.46

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	12/20	0.46

▸	BACE2	Q9Y5Z0	4/20	0.46

▸	CTSD	P07339	2/20	0.44

▸	NPY4R	P50391	7/20	0.43

▸	NPY1R	P25929	5/20	0.43

▸	NPY2R	P49146	5/20	0.43

▸	NPY5R	Q15761	5/20	0.43

▸	KEAP1	Q14145	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
SCHEMBL31484239	0.92	BACE1 (0.49)	BACE1BACE2CTSDNPY4RNPY1R
SCHEMBL31484224	0.92	BACE1 (0.49)	BACE1BACE2CTSDNPY4RNPY1R
SCHEMBL31462070	0.90	KEAP1 (0.45)	BACE1BACE2CTSDNPY4RNPY1R
SCHEMBL11567334	0.88	NPY4R (0.47)	BACE1BACE2CTSDNPY4RNPY1R
SCHEMBL11569777	0.88	NPY4R (0.47)	BACE1BACE2CTSDNPY4RNPY1R
SCHEMBL11567327	0.88	NPY4R (0.47)	BACE1BACE2CTSDNPY4RNPY1R
SCHEMBL31643173	0.88	NPY4R (0.47)	BACE1BACE2CTSDNPY4RNPY1R
SCHEMBL30140870	0.87	NPY4R (0.47)	NPY4RNPY1RNPY2RNPY5R
SCHEMBL29455717	0.87	ENPEP (0.40)	BACE1CTSDNPY4RNPY1RNPY2R
SCHEMBL30658141	0.86	NPY4R (0.42)	NPY4RNPY1RNPY2RNPY5R

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-119751572-A	Elm Huang Gutai, and preparation and application thereof	昆明理工大学	2025-04-04	—	—	CN	disclosed