SCHEMBL7306146

CCOP(=O)(N[C@@H](C)C(=O)N(c1ccc(OC)cc1)[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](CC1CCCCC1)[C@H](O)c1ccco1)OCC

nearest known ligand 0.35

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	11/20	0.35

▸	POLB	P06746	1/20	0.34

▸	UBE2N	P61088	1/20	0.34

▸	CTSD	P07339	1/20	0.34

▸	BACE1	P56817	1/20	0.34

▸	BACE2	Q9Y5Z0	1/20	0.34

▸	CTSL	P07711	3/20	0.32

▸	CTSS	P25774	3/20	0.32

▸	CTSK	P43235	1/20	0.32

▸	MAPT	P10636	1/20	0.32

▸	TSHR	P16473	1/20	0.32

▸	NPSR1	Q6W5P4	1/20	0.32

▸	HTT	P42858	1/20	0.31

▸	ALDH1A1	P00352	1/20	0.31

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
SCHEMBL7269096	0.87	REN (0.38)	RENPOLBUBE2NCTSDBACE1
SCHEMBL7298899	0.83	REN (0.37)	RENPOLBUBE2NCTSDBACE1
SCHEMBL7277581	0.78	REN (0.49)	REN
SCHEMBL7277586	0.78	REN (0.49)	REN
SCHEMBL7269979	0.76	CTSC (0.38)	REN
SCHEMBL7269967	0.76	CTSC (0.38)	REN
SCHEMBL7269098	0.73	PSEN1 (0.41)	RENCTSLCTSS
SCHEMBL7305274	0.69	REN (0.46)	RENCTSLCTSSCTSK
SCHEMBL7305280	0.69	REN (0.46)	RENCTSLCTSSCTSK
SCHEMBL9555653	0.69	REN (0.43)	REN

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-5189023-A	Hypotensive agent	AMERICAN CYANAMID COMPANY (US)	1993-02-23	—	—	US	disclosed
EP-0473936-A1	Renin Inhibitors	AMERICAN CYANAMID COMPANY (US)	1992-03-11	—	—	EP	disclosed