SCHEMBL11052122

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

nearest known ligand 0.50

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	16/20	0.50

▸	CTSD	P07339	3/20	0.49

▸	ECE1	P42892	2/20	0.44

▸	ERBB2	P04626	1/20	0.41

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
SCHEMBL11052116	0.94	BACE1 (0.56)	BACE1CTSDECE1
SCHEMBL11050000	0.94	BACE1 (0.54)	BACE1CTSDECE1
SCHEMBL11049992	0.88	BACE1 (0.60)	BACE1CTSDECE1
SCHEMBL29351532	0.87	NOD1 (0.42)	BACE1CTSDECE1
SCHEMBL29630899	0.87	ECE1 (0.56)	BACE1CTSDECE1
SCHEMBL30817443	0.85	BACE1 (0.47)	BACE1CTSDECE1
SCHEMBL30844356	0.85	BACE1 (0.46)	BACE1ECE1
SCHEMBL29630696	0.85	ECE1 (0.57)	BACE1CTSDECE1
SCHEMBL30122998	0.84	BACE1 (0.47)	BACE1CTSDERBB2
SCHEMBL29477121	0.84	BACE1 (0.61)	BACE1CTSD

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-4426324-A	Immunopotentiating peptides	HOFFMANN-LA ROCHE INC. (US)	1984-01-17	—	—	US	disclosed