SCHEMBL30495789

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

nearest known ligand 0.46

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	KDM1A	O60341	3/20	0.46

▸	REN	P00797	11/20	0.44

▸	CMA1	P23946	1/20	0.43

▸	MAOB	P27338	1/20	0.42

▸	KDM5A	P29375	1/20	0.42

▸	KDM1B	Q8NB78	1/20	0.42

▸	MAPK8	P45983	1/20	0.41

▸	MAPK9	P45984	1/20	0.41

▸	MAPK10	P53779	1/20	0.41

▸	CAPN1	P07384	1/20	0.40

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
SCHEMBL30051206	0.88	ACE (0.51)	KDM1AREN
SCHEMBL30311197	0.87	MAPK8 (0.43)	KDM1ARENMAPK8MAPK9MAPK10
SCHEMBL30051241	0.87	REN (0.55)	RENCMA1MAPK8MAPK9MAPK10
SCHEMBL30997476	0.86	MAPK8 (0.49)	KDM1ARENMAOBKDM5AKDM1B
SCHEMBL30311186	0.86	MAPK8 (0.42)	KDM1ARENCMA1MAPK8MAPK9
SCHEMBL30627049	0.85	REN (0.46)	KDM1ARENCMA1
SCHEMBL30936117	0.85	REN (0.44)	KDM1ARENCMA1MAPK8MAPK9
SCHEMBL30844289	0.85	CMA1 (0.44)	RENCMA1MAPK8MAPK9MAPK10
SCHEMBL30311246	0.85	REN (0.50)	KDM1ARENMAOBKDM5AKDM1B
SCHEMBL30582212	0.85	MAPK8 (0.47)	RENMAPK8MAPK9MAPK10CAPN1

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
US-20230190887-A1	TARGETING G3BP AGGREGATION TO PREVENT NEURODEGENERATION	UNIVERSITY OF SOUTH CAROLINA (US)	2023-06-22	—	—	US	disclosed