SCHEMBL7330516

CC(C)[C@H](NC(=O)[C@](NC(=O)C1CCCC1)(C(=O)C(Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(C)C)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CDYL2	Q8N8U2	1/20	0.47

▸	CDYL	Q9Y232	1/20	0.47

▸	CALCRL	Q16602	2/20	0.41

▸	CTSB	P07858	2/20	0.40

▸	BACE1	P56817	1/20	0.39

▸	PSMB5	P28074	2/20	0.39

▸	HRH1	P35367	2/20	0.39

▸	MEN1	O00255	1/20	0.38

▸	KMT2A	Q03164	1/20	0.38

▸	ATM	Q13315	1/20	0.38

▸	CMA1	P23946	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
SCHEMBL7323521	0.92	CDYL2 (0.41)	CDYL2CDYLCTSBPSMB5MEN1
SCHEMBL7329194	0.82	CDYL2 (0.43)	CDYL2CDYLCALCRLCTSBBACE1
SCHEMBL7323512	0.78	CDYL2 (0.40)	CDYL2CDYLBACE1PSMB5HRH1
SCHEMBL10376858	0.77	BACE1 (0.52)	CDYL2CDYLCALCRLCTSBBACE1
SCHEMBL7331112	0.75	CTSD (0.43)	CDYL2CDYLMEN1KMT2A
SCHEMBL7331268	0.71	REN (0.43)	CMA1
SCHEMBL7331253	0.71	REN (0.43)	CMA1
SCHEMBL30905085	0.71	MME (0.55)	—
SCHEMBL7330506	0.71	CTSD (0.49)	CTSB
SCHEMBL18388623	0.70	ALDH1A1 (0.51)	—

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 2 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	disclosed
EP-0352000-A2	Retroviral protease binding peptides	SMITHKLINE BEECHAM CORPORATION (US)	1990-01-24	—	—	EP	disclosed