SCHEMBL31415942

CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	12/20	0.46

▸	NTSR2	O95665	10/20	0.46

▸	BACE1	P56817	3/20	0.46

▸	CTSD	P07339	2/20	0.46

▸	SORT1	Q99523	4/20	0.43

▸	KEAP1	Q14145	1/20	0.42

▸	OPRM1	P35372	1/20	0.42

▸	OPRD1	P41143	1/20	0.42

▸	BDKRB2	P30411	1/20	0.41

▸	SLC6A2	P23975	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
SCHEMBL31307288	0.89	NTSR1 (0.49)	NTSR1NTSR2SORT1
SCHEMBL30512651	0.86	NTSR1 (0.55)	NTSR1NTSR2KEAP1OPRM1OPRD1
SCHEMBL30930181	0.84	OPRM1 (0.43)	OPRM1OPRD1BDKRB2
SCHEMBL30930182	0.84	RAMP3 (0.50)	BACE1CTSDKEAP1
SCHEMBL30906558	0.84	RAMP3 (0.47)	KEAP1
SCHEMBL30906409	0.84	RAMP3 (0.47)	KEAP1
SCHEMBL30978825	0.83	BACE1 (0.50)	NTSR1NTSR2BACE1CTSDKEAP1
SCHEMBL29575852	0.83	CMA1 (0.51)	NTSR1NTSR2BACE1CTSDSORT1
SCHEMBL31031512	0.83	CAPN1 (0.51)	KEAP1OPRM1OPRD1
SCHEMBL30930174	0.83	RAMP3 (0.50)	—

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-2025002590-A1	TISSUE MHC CLASS I IMMUNOPEPTIDE PATTERN DEDICATED FOR GENERATION OF ANTI-CANCER VACCINES AGAINST NON-SMALL CELL LUNG CANCER (NSCLC), IDENTIFICATION AND ISOLATION OF NSCLC SPECIFIC T CELLS IN HUMANS	UNIWERSYTET GDÁNSKI (PL)	2025-01-02	—	—	WO	claimed