SCHEMBL30198566

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	9/20	0.51

▸	CTSD	P07339	2/20	0.49

▸	F2	P00734	2/20	0.48

▸	MAGI3	Q5TCQ9	1/20	0.47

▸	BACE2	Q9Y5Z0	1/20	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
SCHEMBL29378009	0.90	CTSD (0.58)	CTSD
SCHEMBL29437876	0.88	ACE (0.55)	CTSD
SCHEMBL30477367	0.86	OPRM1 (0.51)	BACE1CTSDBACE2
SCHEMBL30622615	0.86	BACE1 (0.58)	BACE1F2BACE2
SCHEMBL30542169	0.85	BACE1 (0.54)	BACE1CTSDF2BACE2
SCHEMBL30904472	0.84	BACE1 (0.56)	BACE1CTSDMAGI3BACE2
SCHEMBL28220799	0.84	BACE1 (0.49)	BACE1CTSDF2
SCHEMBL30350510	0.84	ACE (0.48)	CTSD
SCHEMBL9451658	0.83	ENPEP (0.52)	—
SCHEMBL9451653	0.83	ENPEP (0.52)	—

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-11566256-B2	Polynucleotides and polypeptides in plants	MENDEL BIOTECHNOLOGY, INC. (US)	2023-01-31	—	—	US	disclosed