SCHEMBL31514337

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

nearest known ligand 0.50

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	9/20	0.50

▸	CTSD	P07339	3/20	0.48

▸	BACE2	Q9Y5Z0	3/20	0.46

▸	ENPEP	Q07075	5/20	0.46

▸	CCNA2	P20248	2/20	0.46

▸	CDK2	P24941	2/20	0.46

▸	CCNA1	P78396	2/20	0.46

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
SCHEMBL30704395	0.93	ENPEP (0.51)	BACE1ENPEP
SCHEMBL30432395	0.91	BACE1 (0.51)	BACE1CTSDBACE2CCNA2CDK2
SCHEMBL31287206	0.89	BACE1 (0.53)	BACE1CTSDBACE2ENPEP
SCHEMBL29392675	0.89	BACE1 (0.53)	BACE1CTSDBACE2ENPEP
SCHEMBL30242230	0.87	BACE1 (0.57)	BACE1CTSDBACE2ENPEP
SCHEMBL30170480	0.87	BACE1 (0.55)	BACE1CTSDBACE2ENPEP
SCHEMBL31134498	0.86	ENPEP (0.57)	BACE1CTSDBACE2ENPEP
SCHEMBL30974262	0.86	BACE1 (0.54)	BACE1CTSDBACE2ENPEP
SCHEMBL29607868	0.86	NTSR2 (0.54)	BACE1CCNA2CDK2CCNA1
SCHEMBL5356649	0.86	ENPEP (0.53)	ENPEP

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-119776332-A	Enzymatic preparation process of histamine dihydrochloride	上海瀚鸿科技股份有限公司	2025-04-08	—	—	CN	disclosed