SCHEMBL31410884

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

nearest known ligand 0.48

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	13/20	0.48

▸	BACE2	Q9Y5Z0	4/20	0.48

▸	GLP1R	P43220	4/20	0.47

▸	SCTR	P47872	1/20	0.47

▸	CTSD	P07339	1/20	0.46

▸	F2	P00734	3/20	0.45

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
SCHEMBL31410826	0.96	GLP1R (0.47)	BACE1BACE2GLP1RSCTRF2
SCHEMBL31410841	0.95	BACE1 (0.45)	BACE1BACE2GLP1RSCTRCTSD
SCHEMBL31307258	0.93	GLP1R (0.51)	BACE1BACE2GLP1RF2
SCHEMBL30320554	0.89	BACE1 (0.51)	BACE1BACE2GLP1RSCTRCTSD
SCHEMBL30720017	0.88	BACE1 (0.46)	BACE1BACE2GLP1RSCTRCTSD
SCHEMBL29461369	0.88	BACE1 (0.54)	BACE1BACE2GLP1RSCTR
SCHEMBL30710217	0.87	BACE1 (0.52)	BACE1BACE2GLP1RSCTRCTSD
SCHEMBL30997475	0.87	F2 (0.41)	BACE1GLP1RSCTRF2
SCHEMBL30589934	0.87	TASP1 (0.50)	BACE1GLP1RF2
SCHEMBL29492577	0.87	BACE1 (0.41)	BACE1BACE2GLP1RSCTR

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-2025002589-A1	TISSUE EXTRACELLULAR PEPTIDE PATTERNS DEDICATED FOR GENERATION OF ANTI-CANCER VACCINES AGAINST SALIVARY GLAND TUMOR, IDENTIFICATION AND ISOLATION OF SALIVARY GLAND TUMOR SPECIFIC T CELLS IN HUMANS	Uniwersytet Gdański (PL)	2025-01-02	—	—	WO	disclosed