SCHEMBL9676607

CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O[Si](C)(C)C(C)(C)C)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C(C)C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	8/20	0.43

▸	CTSS	P25774	1/20	0.41

▸	CTSK	P43235	1/20	0.41

▸	CTSD	P07339	1/20	0.40

▸	CTSE	P14091	1/20	0.40

▸	CA1	P00915	1/20	0.38

▸	CA2	P00918	1/20	0.38

▸	CA7	P43166	1/20	0.38

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
SCHEMBL9677769	1.00	REN (0.43)	RENCTSSCTSKCTSDCTSE
SCHEMBL9551921	1.00	REN (0.43)	RENCTSSCTSKCTSDCTSE
SCHEMBL9676600	1.00	REN (0.43)	RENCTSSCTSKCTSDCTSE
SCHEMBL9551920	1.00	REN (0.43)	RENCTSSCTSKCTSDCTSE
SCHEMBL10866353	1.00	REN (0.43)	RENCTSSCTSKCTSDCTSE
SCHEMBL9676521	0.86	CA1 (0.46)	CTSSCTSKCA1CA2CA7
SCHEMBL9675593	0.86	CA1 (0.46)	CTSSCTSKCA1CA2CA7
SCHEMBL7445228	0.84	CA1 (0.44)	CTSSCTSKCA1CA2CA7
SCHEMBL7438624	0.83	CA1 (0.40)	RENCTSSCTSKCTSDCTSE
SCHEMBL9677665	0.83	REN (0.54)	RENCTSSCTSKCTSDCTSE

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0486478-A2	Renin-inhibiting peptides	THE UPJOHN COMPANY (US)	1992-05-20	—	—	EP	disclosed
US-4880781-A	HYPOTENSIVE AGENTS	THE UPJOHN COMPANY (US)	1989-11-14	—	—	US	disclosed
EP-0173481-A2	Peptides	THE UPJOHN COMPANY (US)	1986-03-05	—	—	EP	disclosed