SCHEMBL7316741

CC[C@H](C)C(=O)NC(=O)[C@H](C(C)C)[C@@H](O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)COc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	13/20	0.45

▸	CTSD	P07339	2/20	0.37

▸	CTSE	P14091	1/20	0.36

▸	CASP3	P42574	1/20	0.36

▸	PSMB5	P28074	1/20	0.35

▸	CTSK	P43235	2/20	0.35

▸	SMN1; SMN2	Q16637	1/20	0.35

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
SCHEMBL9755318	0.89	REN (0.57)	RENCTSDCTSEPSMB5CTSK
SCHEMBL7323845	0.85	REN (0.58)	REN
SCHEMBL7325297	0.80	REN (0.46)	RENCTSDCTSE
SCHEMBL7370152	0.74	REN (0.56)	RENCTSDCTSE
SCHEMBL10521313	0.72	P2RY14 (0.51)	PSMB5SMN1; SMN2
SCHEMBL7285655	0.72	REN (0.49)	RENCTSD
SCHEMBL7285659	0.72	REN (0.49)	RENCTSD
SCHEMBL7364990	0.72	REN (0.51)	REN
SCHEMBL7288779	0.72	GPR34 (0.53)	RENPSMB5
SCHEMBL7366967	0.71	REN (0.46)	RENCTSD

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
US-4864017-A	Novel renin inhibiting peptides having a dihyroxyethylene isostere transition state insert	THE UPJOHN COMPANY (US)	1989-09-05	—	—	US	claimed
EP-0237202-A2	Novel renin inhibiting peptides having a dihydroxyethylene isostere transition state insert	THE UPJOHN COMPANY (US)	1987-09-16	—	—	EP	claimed
WO-1987005302-A1	NOVEL RENIN-INHIBITING PEPTIDES HAVING A DIHYDROXYETHYLENE ISOSTERE TRANSITION STATE INSERT	THE UPJOHN COMPANY (US)	1987-09-11	—	—	WO	claimed