SCHEMBL7320115

CC(=O)N(C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](CC(N)=O)C(=O)NC(Cc1ccccc1)C(O)CC(=O)N(C(=O)[C@@H]1CCCN1)[C@H]([C]=O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	2/20	0.40

▸	CTSD	P07339	15/20	0.40

▸	CTSE	P14091	15/20	0.40

▸	BACE1	P56817	12/20	0.40

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
SCHEMBL7331131	0.88	REN (0.35)	RENCTSDCTSEBACE1
SCHEMBL7326552	0.86	REN (0.34)	RENCTSDCTSEBACE1
SCHEMBL10378305	0.82	REN (0.34)	RENCTSDCTSEBACE1
SCHEMBL7325549	0.80	BACE1 (0.45)	RENCTSDCTSEBACE1
SCHEMBL7320696	0.76	BACE1 (0.38)	RENCTSDBACE1
SCHEMBL7332272	0.73	BACE1 (0.38)	CTSDCTSEBACE1
SCHEMBL7328124	0.69	BACE1 (0.51)	RENCTSDCTSEBACE1
SCHEMBL7328119	0.69	BACE1 (0.51)	RENCTSDCTSEBACE1
SCHEMBL7330209	0.69	BACE1 (0.51)	RENCTSDCTSEBACE1
SCHEMBL10376835	0.66	OPRM1 (0.48)	—

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-1990000399-A1	RETROVIRAL PROTEASE BINDING PEPTIDES	SMITHKLINE BECKMAN CORPORATION (US)	1990-01-25	—	—	WO	claimed
EP-0352000-A2	Retroviral protease binding peptides	SMITHKLINE BEECHAM CORPORATION (US)	1990-01-24	—	—	EP	claimed
WO-1990000399-A1	RETROVIRAL PROTEASE BINDING PEPTIDES	SMITHKLINE BECKMAN CORPORATION (US)	1990-01-25	—	—	WO	disclosed
EP-0352000-A2	Retroviral protease binding peptides	SMITHKLINE BEECHAM CORPORATION (US)	1990-01-24	—	—	EP	disclosed