SCHEMBL10464551

CC[C@H](C)[C@H](NC(O)CC(O)C(CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	16/20	0.65

▸	CTSD	P07339	1/20	0.55

▸	AGTR1	P30556	1/20	0.54

▸	AGTR2	P50052	1/20	0.54

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
SCHEMBL10464548	0.83	REN (0.56)	RENCTSD
SCHEMBL13234128	0.81	AGTR1 (0.69)	RENAGTR1AGTR2
Angiotensin Ii SCHEMBL1189	0.79	AGTR2 (0.84)	RENAGTR1AGTR2
Angiotensin Ii SCHEMBL2566771	0.79	AGTR2 (0.84)	RENAGTR1AGTR2
Angiotensin Ii SCHEMBL13232382	0.79	AGTR2 (0.84)	RENAGTR1AGTR2
SCHEMBL29778186	0.79	AGTR2 (0.77)	RENAGTR1AGTR2
Angiotensin Ii SCHEMBL21408200	0.78	AGTR2 (0.82)	RENAGTR1AGTR2
Angiotensin Ii SCHEMBL14990505	0.78	AGTR2 (0.83)	RENAGTR1AGTR2
Angiotensin Ii SCHEMBL21267957	0.78	AGTR2 (0.83)	RENAGTR1AGTR2
Angiotensin Ii SCHEMBL3465991	0.78	AGTR2 (0.83)	RENAGTR1AGTR2

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-4894437-A	Novel renin inhibiting polypeptide analogs containing S-aryl-D- or L- or DL-cysteinyl, 3-(arylthio)lactic acid or 3-(arylthio)alkyl moieties	THE UPJOHN COMPANY (US)	1990-01-16	—	—	US	claimed