SCHEMBL9807233

CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N1C(=O)CCC(=O)[C@]1(Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	EPHA2	P29317	2/20	0.51

▸	NTSR1	P30989	17/20	0.47

▸	NTSR2	O95665	16/20	0.47

▸	SORT1	Q99523	16/20	0.47

▸	KDM1A	O60341	1/20	0.43

▸	MAOB	P27338	1/20	0.43

▸	KDM5A	P29375	1/20	0.43

▸	KDM1B	Q8NB78	1/20	0.43

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
SCHEMBL9807256	0.83	EPHA2 (0.59)	EPHA2NTSR1NTSR2SORT1KDM1A
SCHEMBL9807245	0.83	EPHA2 (0.61)	EPHA2NTSR1NTSR2SORT1
SCHEMBL8969918	0.80	EPHA2 (0.49)	EPHA2NTSR1NTSR2SORT1KDM1A
SCHEMBL10378224	0.79	EPHA2 (0.48)	EPHA2NTSR1NTSR2SORT1KDM1A
SCHEMBL10378950	0.79	EPHA2 (0.48)	EPHA2NTSR1NTSR2SORT1KDM1A
SCHEMBL29980542	0.78	EPHA2 (0.59)	EPHA2NTSR1NTSR2SORT1KDM1A
SCHEMBL8970642	0.78	EPHA2 (0.47)	EPHA2NTSR1NTSR2SORT1KDM1A
SCHEMBL29379857	0.78	SLC6A2 (0.60)	EPHA2NTSR1NTSR2SORT1
SCHEMBL9551316	0.77	EPHA2 (0.59)	EPHA2NTSR1NTSR2SORT1
SCHEMBL9807306	0.77	EPHA2 (0.62)	EPHA2KDM1AMAOBKDM5AKDM1B

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
EP-0146266-B1	ENZYME-RESISTANT IMMUNOMODULATORY PEPTIDES	ORTHO PHARMACEUTICAL CORPORATION (US)	1991-05-22	—	—	EP	disclosed