SCHEMBL9740310

CC(=O)c1c[nH]c([C@@H](O)[C@@H](CC2CCCCC2)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H](CC(=O)NCCCN2CCCC2=O)Cc2c[nH]c3ccccc23)n1

nearest known ligand 0.41

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	6/20	0.41

▸	C5AR1	P21730	2/20	0.38

▸	MMP2	P08253	3/20	0.38

▸	MMP9	P14780	3/20	0.38

▸	MMP8	P22894	3/20	0.38

▸	PSMB8	P28062	3/20	0.37

▸	PSMB9	P28065	1/20	0.37

▸	CTSL	P07711	3/20	0.36

▸	CTSS	P25774	3/20	0.36

▸	CTSK	P43235	3/20	0.36

▸	CTSH	P09668	1/20	0.36

▸	PSMB5	P28074	2/20	0.36

▸	MMP1	P03956	2/20	0.36

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
SCHEMBL9740313	1.00	REN (0.41)	RENC5AR1MMP2MMP9MMP8
SCHEMBL9740998	0.79	REN (0.43)	RENMMP2MMP9MMP8
SCHEMBL9740996	0.79	REN (0.43)	RENMMP2MMP9MMP8
SCHEMBL9739604	0.77	MMP2 (0.51)	RENMMP2MMP9MMP8
SCHEMBL9739605	0.77	MMP2 (0.51)	RENMMP2MMP9MMP8
SCHEMBL9741583	0.76	MMP2 (0.51)	RENMMP2MMP9MMP8PSMB8
SCHEMBL9741586	0.76	MMP2 (0.51)	RENMMP2MMP9MMP8PSMB8
SCHEMBL9740478	0.73	REN (0.53)	RENPSMB8PSMB9
SCHEMBL9740474	0.73	REN (0.53)	RENPSMB8PSMB9
SCHEMBL9740165	0.71	REN (0.52)	RENPSMB8PSMB9

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-5104869-A	Renin inhibitors	AMERICAN CYANAMID COMPANY (US)	1992-04-14	—	—	US	claimed