SCHEMBL30019401

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

nearest known ligand 0.45

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	4/20	0.43

▸	OPRD1	P41143	4/20	0.43

▸	OPRK1	P41145	2/20	0.43

▸	IL23R	Q5VWK5	1/20	0.39

▸	NAA50	Q9GZZ1	1/20	0.39

▸	NTSR1	P30989	1/20	0.38

▸	SYK	P43405	1/20	0.38

▸	GRPR	P30550	1/20	0.38

▸	RAMP3	O60896	1/20	0.38

▸	CALCR	P30988	1/20	0.38

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
SCHEMBL30355007	0.95	OPRL1 (0.39)	OPRM1OPRD1OPRK1
SCHEMBL30589008	0.95	OPRL1 (0.39)	OPRM1OPRD1OPRK1
SCHEMBL29390017	0.91	OPRM1 (0.40)	OPRM1OPRD1OPRK1IL23RSYK
SCHEMBL30183204	0.84	OPRM1 (0.36)	OPRM1OPRD1OPRK1GRPR
SCHEMBL29406776	0.84	FNTA (0.43)	OPRM1OPRD1OPRK1
SCHEMBL30576955	0.82	KEAP1 (0.42)	IL23RRAMP3CALCR
SCHEMBL29561284	0.82	OPRL1 (0.43)	OPRM1OPRD1OPRK1IL23RGRPR
SCHEMBL31256786	0.82	OPRM1 (0.45)	OPRM1OPRD1OPRK1IL23RGRPR
SCHEMBL24573526	0.81	BMP1 (0.38)	IL23RSYKGRPR
SCHEMBL31666002	0.81	BACE1 (0.45)	—

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-115261317-A	Method for culturing cells, and kit and apparatus for the same	朱诺治疗学有限公司	2022-11-01	—	—	CN	disclosed