SCHEMBL30296833

CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	3/20	0.54

▸	OPRD1	P41143	3/20	0.54

▸	OPRK1	P41145	2/20	0.54

▸	CTSB	P07858	1/20	0.54

▸	BACE1	P56817	5/20	0.51

▸	BACE2	Q9Y5Z0	1/20	0.51

▸	TFPI	P10646	1/20	0.49

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
SCHEMBL29409626	0.94	BACE1 (0.59)	BACE1BACE2
SCHEMBL30751951	0.91	CTSB (0.57)	OPRM1OPRD1OPRK1CTSBBACE1
SCHEMBL29416121	0.87	BACE1 (0.56)	OPRM1OPRD1OPRK1BACE1BACE2
SCHEMBL29415987	0.87	BACE1 (0.56)	OPRM1OPRD1OPRK1BACE1BACE2
SCHEMBL31443264	0.85	OPRD1 (0.62)	OPRM1OPRD1OPRK1CTSB
SCHEMBL30658359	0.84	OPRM1 (0.61)	OPRM1OPRD1OPRK1CTSBBACE1
SCHEMBL31174213	0.84	BACE1 (0.56)	BACE1BACE2
SCHEMBL29416179	0.83	BACE1 (0.63)	BACE1BACE2
SCHEMBL29625263	0.83	FNTA (0.62)	BACE1BACE2
SCHEMBL11309707	0.83	OPRM1 (0.52)	OPRM1OPRD1OPRK1

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
CN-107660150-B	IL-18 binding proteins (IL-18 BP) and antibodies in inflammatory diseases	AB2生物股份有限公司	2023-10-24	—	—	CN	disclosed