SCHEMBL31477658

CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	7/20	0.65

▸	NTSR1	P30989	7/20	0.63

▸	NTSR2	O95665	4/20	0.60

▸	SORT1	Q99523	3/20	0.59

▸	AGTR1	P30556	1/20	0.58

▸	AGTR2	P50052	1/20	0.58

▸	OPRM1	P35372	1/20	0.58

▸	OPRK1	P41145	1/20	0.58

▸	F2	P00734	1/20	0.57

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
SCHEMBL31477655	1.00	OPRD1 (0.65)	OPRD1NTSR1NTSR2SORT1AGTR1
SCHEMBL29972798	0.91	C5AR1 (0.56)	OPRD1NTSR1NTSR2SORT1OPRM1
SCHEMBL31280899	0.84	NTSR1 (0.74)	OPRD1NTSR1NTSR2SORT1OPRM1
SCHEMBL29583466	0.84	OPRD1 (0.64)	OPRD1NTSR1NTSR2
SCHEMBL29516648	0.83	OPRD1 (0.78)	OPRD1NTSR1OPRM1OPRK1
SCHEMBL29725007	0.83	NTSR2 (0.71)	OPRD1NTSR1NTSR2SORT1OPRM1
SCHEMBL29588066	0.82	OPRD1 (0.68)	OPRD1NTSR1F2
SCHEMBL29496684	0.82	NTSR2 (0.67)	OPRD1NTSR1NTSR2SORT1OPRM1
SCHEMBL30284447	0.82	NTSR1 (0.56)	NTSR1NTSR2SORT1OPRM1OPRK1
SCHEMBL29386868	0.81	OPRD1 (0.82)	OPRD1NTSR1OPRM1OPRK1F2

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-2025068686-A1	TREATMENT FOR BATTEN DISEASE	THE ROYAL VETERINARY COLLEGE (GB)	2025-04-03	—	—	WO	disclosed