SCHEMBL8858202

CCP(=O)(CN(C(=O)CCCc1ccccc1)[C@@H](CC(C)C)C(=O)Nc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(C)=O

nearest known ligand 0.54

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	MMP3	P08254	10/20	0.54

▸	MMP1	P03956	3/20	0.54

▸	MMP2	P08253	3/20	0.47

▸	CPA1	P15085	1/20	0.44

▸	CPA2	P48052	1/20	0.44

▸	CPA4	Q9UI42	1/20	0.44

▸	FKBP1A	P62942	2/20	0.41

▸	PLK1	P53350	2/20	0.38

▸	PLK3	Q9H4B4	1/20	0.37

▸	PLK2	Q9NYY3	1/20	0.37

▸	TACR1	P25103	1/20	0.37

▸	PSMB9	P28065	1/20	0.37

▸	F2	P00734	2/20	0.37

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
SCHEMBL7391702	0.89	MMP3 (0.64)	MMP3MMP1MMP2CPA1CPA2
SCHEMBL8343741	0.88	MMP3 (0.47)	MMP3MMP1MMP2CPA1CPA2
SCHEMBL7401167	0.87	MMP3 (0.58)	MMP3MMP1MMP2CPA1CPA2
SCHEMBL7401165	0.87	MMP3 (0.58)	MMP3MMP1MMP2CPA1CPA2
SCHEMBL7401520	0.80	MMP3 (0.54)	MMP3MMP1MMP2CPA1CPA2
SCHEMBL7402164	0.78	MMP3 (0.51)	MMP3MMP1MMP2CPA1CPA2
SCHEMBL6416221	0.77	MMP3 (0.57)	MMP3MMP1MMP2CPA1CPA2
SCHEMBL6416214	0.77	MMP3 (0.57)	MMP3MMP1MMP2CPA1CPA2
SCHEMBL7397723	0.77	KDM4E (0.45)	MMP3MMP1MMP2
SCHEMBL7401524	0.76	MMP3 (0.66)	MMP3MMP1MMP2FKBP1A

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-5679700-A	STROMELYSIN INHIBITOR	MERCK & CO., INC. (US)	1997-10-21	—	—	US	disclosed