SCHEMBL30974504

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

nearest known ligand 0.45

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	8/20	0.45

▸	BACE2	Q9Y5Z0	2/20	0.45

▸	GLP1R	P43220	12/20	0.45

▸	SCTR	P47872	1/20	0.45

▸	CTSD	P07339	1/20	0.44

▸	GCGR	P47871	1/20	0.43

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
SCHEMBL30974099	0.94	BACE1 (0.44)	BACE1BACE2GLP1RSCTRCTSD
SCHEMBL30974298	0.90	FOLH1 (0.42)	BACE1BACE2GLP1RSCTRGCGR
SCHEMBL29625338	0.90	BACE1 (0.47)	BACE1BACE2CTSD
SCHEMBL30505876	0.88	CCNA2 (0.44)	BACE1GLP1RSCTRGCGR
SCHEMBL30512516	0.88	BACE1 (0.46)	BACE1GLP1R
SCHEMBL29757432	0.88	BACE1 (0.48)	BACE1BACE2CTSD
SCHEMBL29625334	0.88	CCNA2 (0.43)	BACE1BACE2CTSD
SCHEMBL30512656	0.88	BACE1 (0.45)	BACE1BACE2CTSD
SCHEMBL28519386	0.88	GLP1R (0.42)	BACE1BACE2GLP1RSCTRCTSD
SCHEMBL30974478	0.87	GLP1R (0.49)	GLP1RSCTRGCGR

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
WO-2024132726-A1	SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE	UNIWERSYTET GDANSKI (PL)	2024-06-27	—	—	WO	disclosed