SCHEMBL31073587

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

nearest known ligand 0.61

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	PTH1R	Q03431	7/20	0.55

▸	CALCR	P30988	3/20	0.54

▸	BACE1	P56817	1/20	0.53

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
SCHEMBL30433489	0.88	BACE1 (0.57)	PTH1RCALCRBACE1
SCHEMBL30712895	0.87	OPRM1 (0.60)	—
SCHEMBL30495638	0.86	BACE1 (0.59)	BACE1
SCHEMBL29746858	0.86	PTH1R (0.60)	PTH1R
SCHEMBL30974275	0.86	OPRM1 (0.55)	BACE1
SCHEMBL30495711	0.85	GLP1R (0.57)	PTH1RCALCRBACE1
SCHEMBL30431901	0.85	OPRM1 (0.54)	BACE1
SCHEMBL29728670	0.85	BACE1 (0.61)	PTH1RCALCRBACE1
SCHEMBL30576978	0.84	VIPR1 (0.58)	PTH1RCALCR
SCHEMBL31174213	0.84	BACE1 (0.56)	PTH1RBACE1

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-118777592-A	Colloidal gold test strip for detecting anti-PLA 2R antibody, preparation method thereof, kit and application	江南大学	2024-10-15	—	—	CN	disclosed