SCHEMBL7380816

CC(C)OC(=O)[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)N1CCC(=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	4/20	0.48

▸	ACE	P12821	7/20	0.46

▸	ACE2	Q9BYF1	5/20	0.46

▸	F2	P00734	1/20	0.45

▸	GAA	P10253	1/20	0.44

▸	ATM	Q13315	1/20	0.43

▸	L3MBTL1	Q9Y468	1/20	0.43

▸	OPRM1	P35372	1/20	0.43

▸	ELANE	P08246	1/20	0.42

▸	TACR1	P25103	1/20	0.42

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
SCHEMBL7356132	0.93	F2 (0.51)	RENACEACE2F2GAA
SCHEMBL7356122	0.93	F2 (0.51)	RENACEACE2F2GAA
SCHEMBL7349627	0.89	OPRM1 (0.48)	ACEACE2F2OPRM1
SCHEMBL7349617	0.89	OPRM1 (0.48)	ACEACE2F2OPRM1
SCHEMBL7347378	0.86	OPRM1 (0.48)	ACEACE2OPRM1TACR1
SCHEMBL6701580	0.86	OPRM1 (0.48)	ACEACE2OPRM1TACR1
SCHEMBL7348394	0.85	ELANE (0.46)	RENACEACE2F2OPRM1
SCHEMBL7348952	0.83	CAPN1 (0.57)	OPRM1TACR1
SCHEMBL7348938	0.83	CAPN1 (0.57)	OPRM1TACR1
SCHEMBL7347204	0.82	OPRM1 (0.49)	ACEACE2GAAOPRM1TACR1

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
WO-1993025574-A1	INHIBITORS OF ANGIOTENSIN I CHYMASE(S) INCLUDING HUMAN HEART CHYMASE	PFIZER INC. (US)	1993-12-23	—	—	WO	disclosed