SCHEMBL30242271

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	11/20	0.61

▸	BACE2	Q9Y5Z0	4/20	0.61

▸	NPY4R	P50391	4/20	0.60

▸	NPY1R	P25929	3/20	0.60

▸	NPY2R	P49146	3/20	0.60

▸	PTPN1	P18031	2/20	0.55

▸	IL1RN	P18510	1/20	0.54

▸	ERAP2	Q6P179	1/20	0.54

▸	NPY5R	Q15761	2/20	0.54

▸	CTSD	P07339	1/20	0.53

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
SCHEMBL32691437	0.92	BACE1 (0.58)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL29616324	0.90	BACE1 (0.58)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL30512662	0.90	NPY4R (0.62)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL29531210	0.90	NPY4R (0.55)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL29530897	0.90	NPY4R (0.55)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL29531366	0.90	NPY4R (0.55)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL29403649	0.90	NPY4R (0.55)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL31433273	0.90	BACE1 (0.59)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL29625332	0.89	NPY4R (0.60)	BACE1BACE2NPY4RNPY1RNPY2R
SCHEMBL31412760	0.89	BACE1 (0.54)	BACE1BACE2NPY4RNPY1RNPY2R

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-115697069-A	Hypoallergenic recombinant milk proteins and compositions comprising the same	完美日股份有限公司	2023-02-03	—	—	CN	disclosed