SCHEMBL30690380

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	CTSB	P07858	1/20	0.47

▸	OPRM1	P35372	4/20	0.45

▸	OPRD1	P41143	4/20	0.45

▸	OPRK1	P41145	2/20	0.43

▸	BACE1	P56817	2/20	0.39

▸	FURIN	P09958	1/20	0.39

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
SCHEMBL30690370	0.99	CTSB (0.46)	CTSBOPRM1OPRD1OPRK1BACE1
SCHEMBL30950645	0.92	OPRM1 (0.45)	CTSBOPRM1OPRD1OPRK1BACE1
SCHEMBL30950658	0.92	OPRM1 (0.45)	CTSBOPRM1OPRD1OPRK1BACE1
SCHEMBL29822509	0.86	OPRM1 (0.51)	CTSBOPRM1OPRD1OPRK1BACE1
SCHEMBL29886805	0.86	CTSB (0.48)	CTSBOPRM1OPRD1OPRK1BACE1
SCHEMBL10862333	0.85	CTSD (0.42)	CTSBOPRM1OPRD1OPRK1
SCHEMBL10862344	0.85	CTSD (0.42)	CTSBOPRM1OPRD1OPRK1
SCHEMBL31643053	0.85	CTSB (0.46)	CTSBOPRM1OPRD1BACE1
SCHEMBL10861953	0.85	OPRM1 (0.43)	CTSBOPRM1OPRD1OPRK1
SCHEMBL10861943	0.85	OPRM1 (0.43)	CTSBOPRM1OPRD1OPRK1

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-110041432-B	chimeric antigen receptor	细胞基因公司	2023-12-05	—	—	CN	disclosed