SCHEMBL7110562

CC(C)C[C@@H](/C=C/S(=O)(=O)c1ccccc1)NC(=O)C(C)NC(=O)C(C(C)C)N(N)C(=O)OC(C)(C)C.CCOP(=O)(CS(=O)(=O)c1ccccc1)OCC

nearest known ligand 0.40

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	PSMB5	P28074	7/20	0.40

▸	CTSL	P07711	5/20	0.40

▸	CTSK	P43235	5/20	0.38

▸	CTSB	P07858	4/20	0.38

▸	CTSS	P25774	3/20	0.38

▸	CTSH	P09668	2/20	0.38

▸	CTSC	P53634	2/20	0.38

▸	CASP1	P29466	1/20	0.35

▸	PSMB2	P49721	2/20	0.35

▸	PSMB8	P28062	1/20	0.35

▸	PSMB10	P40306	1/20	0.35

▸	CASP3	P42574	2/20	0.34

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
SCHEMBL7154068	0.90	CTSL (0.47)	PSMB5CTSLCTSKCTSBCTSS
SCHEMBL6672751	0.90	CTSL (0.47)	PSMB5CTSLCTSKCTSBCTSS
SCHEMBL6674820	0.90	CTSL (0.47)	PSMB5CTSLCTSKCTSBCTSS
SCHEMBL7110566	0.84	PSMB5 (0.44)	PSMB5CTSLCTSKCTSBCTSS
SCHEMBL7110567	0.84	PSMB5 (0.44)	PSMB5CTSLCTSKCTSBCTSS
SCHEMBL6675158	0.77	PSMB5 (0.48)	PSMB5CTSCPSMB2PSMB8PSMB10
SCHEMBL7114388	0.77	PSMB5 (0.48)	PSMB5CTSCPSMB2PSMB8PSMB10
SCHEMBL7113794	0.72	PSMB5 (0.52)	PSMB5CTSLCTSKCTSBCTSS
SCHEMBL6672754	0.72	PSMB5 (0.52)	PSMB5CTSLCTSKCTSBCTSS
SCHEMBL6672753	0.72	PSMB5 (0.52)	PSMB5CTSLCTSKCTSBCTSS

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-20030092067-A1	Substrates and inhibitors of proteolytic enzymes	PEPTIDE THERAPEUTICS LIMITED	2003-05-15	—	—	US	disclosed