SCHEMBL10721020

CC(C)C[C@@H](NC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)[C@@H](Cc1cccc2cccnc12)NC(=O)OCc1ccccc1)O/[P+]([O-])=C/C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	1/20	0.44

▸	MMP2	P08253	1/20	0.42

▸	MMP9	P14780	1/20	0.42

▸	MMP8	P22894	1/20	0.42

▸	CTSB	P07858	5/20	0.40

▸	CTSL	P07711	4/20	0.40

▸	CTSK	P43235	3/20	0.40

▸	HTRA1	Q92743	1/20	0.39

▸	CTSS	P25774	1/20	0.39

▸	HDAC1	Q13547	3/20	0.39

▸	HDAC4	P56524	2/20	0.39

▸	HDAC6	Q9UBN7	2/20	0.39

▸	CAPN1	P07384	1/20	0.39

▸	CASP3	P42574	1/20	0.39

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
SCHEMBL10721167	1.00	REN (0.44)	RENMMP2MMP9MMP8CTSB
SCHEMBL11015359	0.92	REN (0.52)	RENCTSBCTSLCTSKCASP3
SCHEMBL10724569	0.92	REN (0.52)	RENCTSBCTSLCTSKCASP3
SCHEMBL10720809	0.92	REN (0.52)	RENCTSBCTSLCTSKCASP3
SCHEMBL10725321	0.92	REN (0.52)	RENCTSBCTSLCTSKCASP3
SCHEMBL10724912	0.92	REN (0.52)	RENCTSBCTSLCTSKCASP3
SCHEMBL10725238	0.89	REN (0.43)	RENMMP2MMP9MMP8CTSB
SCHEMBL10720915	0.86	REN (0.49)	RENMMP9MMP8CTSBCTSL
SCHEMBL10724623	0.86	REN (0.49)	RENMMP9MMP8CTSBCTSL
SCHEMBL10722840	0.86	REN (0.49)	RENMMP9MMP8CTSBCTSL

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-4698329-A	HYPOTENSIVE AGENTS	SANKYO COMPANY, LIMITED (JP)	1987-10-06	—	—	US	disclosed