SCHEMBL29607893

N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	KDM1A	O60341	3/20	0.48

▸	OPRM1	P35372	9/20	0.45

▸	OPRK1	P41145	9/20	0.45

▸	ACE	P12821	2/20	0.44

▸	MAOB	P27338	1/20	0.44

▸	KDM5A	P29375	1/20	0.44

▸	KDM1B	Q8NB78	1/20	0.44

▸	MAPK8	P45983	1/20	0.43

▸	MAPK9	P45984	1/20	0.43

▸	MAPK10	P53779	1/20	0.43

▸	REN	P00797	3/20	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
SCHEMBL29442098	0.93	KDM1A (0.47)	KDM1AOPRM1OPRK1MAOBKDM5A
SCHEMBL7351817	0.93	MAPK8 (0.41)	KDM1AOPRM1OPRK1ACEMAOB
SCHEMBL7351804	0.93	MAPK8 (0.41)	KDM1AOPRM1OPRK1ACEMAOB
SCHEMBL29855959	0.92	KDM1A (0.47)	KDM1AOPRM1OPRK1ACEMAOB
SCHEMBL29548952	0.92	KDM1A (0.48)	KDM1AOPRM1OPRK1MAOBKDM5A
SCHEMBL31696335	0.90	KDM1A (0.54)	KDM1AOPRM1OPRK1MAOBKDM5A
SCHEMBL3865485	0.89	MAPK8 (0.50)	KDM1AOPRM1OPRK1MAOBKDM5A
SCHEMBL31165809	0.89	MAPK8 (0.45)	KDM1AOPRM1OPRK1MAOBKDM5A
SCHEMBL29588517	0.88	ACE (0.52)	ACEREN
SCHEMBL29837381	0.87	MAPK8 (0.43)	KDM1AOPRM1OPRK1MAOBKDM5A

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-20220120732-A1	TREATMENT OF DISEASES WITH MULTIMERIC PEPTIDES	RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL)	2022-04-21	—	—	US	disclosed