SCHEMBL30402085

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	KDM1A	O60341	3/20	0.55

▸	MAOB	P27338	1/20	0.50

▸	KDM5A	P29375	1/20	0.50

▸	KDM1B	Q8NB78	1/20	0.50

▸	MAPK8	P45983	1/20	0.49

▸	MAPK9	P45984	1/20	0.49

▸	MAPK10	P53779	1/20	0.49

▸	REN	P00797	10/20	0.48

▸	TFPI	P10646	2/20	0.45

▸	NPY1R	P25929	2/20	0.45

▸	NPY2R	P49146	2/20	0.45

▸	NPY4R	P50391	2/20	0.45

▸	NPY5R	Q15761	2/20	0.45

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
SCHEMBL30401697	1.00	KDM1A (0.55)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30400701	0.98	KDM1A (0.57)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401366	0.98	KDM1A (0.57)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30311123	0.98	KDM1A (0.55)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401786	0.98	KDM1A (0.55)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401671	0.98	KDM1A (0.55)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30399513	0.98	KDM1A (0.55)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401369	0.98	KDM1A (0.55)	KDM1AMAOBKDM5AKDM1BMAPK8
Acetic Acid SCHEMBL30311247	0.96	KDM1A (0.54)	KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401733	0.96	KDM1A (0.57)	KDM1AMAOBKDM5AKDM1BMAPK8

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-116003529-A	Polypeptide and application thereof in repairing mucous membrane injury or skin injury	四川好医生攀西药业有限责任公司	2023-04-25	—	—	CN	disclosed