SCHEMBL30512701

CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	KDM1A	O60341	3/20	0.50

▸	MAOB	P27338	1/20	0.46

▸	KDM5A	P29375	1/20	0.46

▸	KDM1B	Q8NB78	1/20	0.46

▸	BACE1	P56817	4/20	0.44

▸	CTSD	P07339	2/20	0.44

▸	GRIN2D	O15399	1/20	0.42

▸	GRIN3B	O60391	1/20	0.42

▸	GRIN1	Q05586	1/20	0.42

▸	GRIN2A	Q12879	1/20	0.42

▸	GRIN2B	Q13224	1/20	0.42

▸	GRIN2C	Q14957	1/20	0.42

▸	GRIN3A	Q8TCU5	1/20	0.42

▸	MAPK8	P45983	1/20	0.41

▸	MAPK9	P45984	1/20	0.41

▸	MAPK10	P53779	1/20	0.41

▸	REN	P00797	4/20	0.39

▸	NPY1R	P25929	2/20	0.38

▸	NPY2R	P49146	2/20	0.38

▸	NPY4R	P50391	2/20	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
SCHEMBL29466224	0.90	KDM1A (0.61)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30786590	0.89	BACE1 (0.48)	KDM1ABACE1CTSDMAPK8MAPK9
SCHEMBL29466227	0.88	KDM1A (0.57)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30021011	0.87	KDM1A (0.47)	KDM1AMAOBKDM5AKDM1BBACE1
SCHEMBL30311231	0.87	KDM1A (0.50)	KDM1AMAOBKDM5AKDM1BBACE1
SCHEMBL29473678	0.87	MAPK8 (0.52)	KDM1AMAOBKDM5AKDM1BGRIN2D
SCHEMBL38658310	0.86	KDM1A (0.44)	KDM1AMAOBKDM5AKDM1BBACE1
SCHEMBL38659777	0.86	KDM1A (0.44)	KDM1AMAOBKDM5AKDM1BBACE1
SCHEMBL30311449	0.85	BACE1 (0.47)	KDM1AMAOBKDM5AKDM1BBACE1
SCHEMBL29725303	0.85	NMT1 (0.39)	KDM1A

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-116490215-A	Targeted mediated endocytic drug delivery	CRM医疗有限公司	2023-07-25	—	—	CN	disclosed