SCHEMBL29435292

CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	13/20	0.51

▸	CTSD	P07339	2/20	0.44

▸	F2	P00734	4/20	0.43

▸	KISS1R	Q969F8	2/20	0.42

▸	TASP1	Q9H6P5	1/20	0.42

▸	BACE2	Q9Y5Z0	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
SCHEMBL30262090	0.92	BACE1 (0.47)	BACE1CTSDF2
SCHEMBL30262132	0.88	KISS1R (0.40)	BACE1F2KISS1R
SCHEMBL31307258	0.88	GLP1R (0.51)	BACE1F2BACE2
SCHEMBL30831910	0.87	BACE1 (0.45)	BACE1
SCHEMBL31303182	0.86	BACE1 (0.48)	BACE1CTSDBACE2
SCHEMBL30589934	0.86	TASP1 (0.50)	BACE1F2KISS1RTASP1
SCHEMBL30442348	0.85	BACE1 (0.49)	BACE1CTSDBACE2
SCHEMBL30554853	0.85	BACE1 (0.46)	BACE1CTSDF2TASP1
SCHEMBL30688995	0.85	BACE1 (0.45)	BACE1CTSDBACE2
SCHEMBL30293834	0.85	NTSR2 (0.45)	BACE1F2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-113234123-B	Nereid lung cancer-resistant oligopeptide and application thereof	杭州医学院	2022-03-25	—	—	CN	disclosed
CN-113234123-B	Nereid lung cancer-resistant oligopeptide and application thereof	杭州医学院	2022-03-25	—	—	CN	disclosed