SCHEMBL31410882

C[C@@H](O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	SLC6A2	P23975	1/20	0.67

▸	OPRD1	P41143	7/20	0.61

▸	OPRM1	P35372	5/20	0.61

▸	NTSR2	O95665	3/20	0.56

▸	NTSR1	P30989	3/20	0.56

▸	SORT1	Q99523	2/20	0.56

▸	AGTR1	P30556	1/20	0.55

▸	AGTR2	P50052	1/20	0.55

▸	OPRK1	P41145	1/20	0.55

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
SCHEMBL31410865	0.94	SLC6A2 (0.64)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL31307249	0.93	SLC6A2 (0.66)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL29530789	0.91	SLC6A2 (0.70)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL29530950	0.91	SLC6A2 (0.70)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL29402848	0.88	SLC6A2 (0.77)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL29353395	0.88	SLC6A2 (0.77)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL31473060	0.88	NTSR1 (0.53)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL30242503	0.88	SLC6A2 (0.63)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL29591704	0.88	SLC6A2 (0.67)	SLC6A2OPRD1OPRM1NTSR2NTSR1
SCHEMBL29753383	0.87	OPRM1 (0.57)	SLC6A2OPRD1OPRM1NTSR2NTSR1

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