SCHEMBL11566909

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

nearest known ligand 0.51

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	12/20	0.51

▸	BACE2	Q9Y5Z0	3/20	0.51

▸	PTPN1	P18031	3/20	0.49

▸	IL1RN	P18510	1/20	0.48

▸	ERAP2	Q6P179	1/20	0.48

▸	NPY1R	P25929	3/20	0.46

▸	NPY4R	P50391	3/20	0.46

▸	NPY2R	P49146	1/20	0.46

▸	CTSD	P07339	1/20	0.45

▸	NPY5R	Q15761	3/20	0.45

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
SCHEMBL11568629	0.88	BACE1 (0.55)	BACE1BACE2PTPN1IL1RNERAP2
SCHEMBL31696295	0.87	BACE1 (0.61)	BACE1BACE2PTPN1IL1RNERAP2
SCHEMBL28163385	0.85	FOLH1 (0.47)	NPY1RNPY4RNPY2RNPY5R
SCHEMBL2182731	0.83	NPY4R (0.44)	IL1RNERAP2NPY1RNPY4RNPY2R
SCHEMBL2182721	0.83	NPY4R (0.44)	IL1RNERAP2NPY1RNPY4RNPY2R
SCHEMBL5150941	0.82	NAALAD2 (0.46)	BACE1BACE2IL1RNERAP2NPY1R
SCHEMBL29973288	0.82	BACE1 (0.65)	BACE1BACE2PTPN1NPY1RNPY4R
SCHEMBL30123009	0.82	NAALAD2 (0.61)	BACE1BACE2IL1RNERAP2NPY1R
SCHEMBL2183598	0.81	NAALAD2 (0.49)	IL1RNERAP2
SCHEMBL1372552	0.81	OPRD1 (0.56)	BACE1BACE2

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
US-4164571-A	Medicament which antagonizes the action of gastrin and related polypeptides	COMMISSARIAT A L'ENERGIE ATOMIQUE (FR)	1979-08-14	—	—	US	disclosed