SCHEMBL7399623

CC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)NCCP(=O)(O)C[C@H](CCc1ccccc1)C(=O)N(C(=O)[C@@H](N)CC(C)C)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	MMP3	P08254	16/20	0.60

▸	MMP2	P08253	5/20	0.56

▸	MMP1	P03956	3/20	0.54

▸	CPA1	P15085	1/20	0.52

▸	CPA2	P48052	1/20	0.52

▸	CPA4	Q9UI42	1/20	0.52

▸	ERAP2	Q6P179	1/20	0.44

▸	ERAP1	Q9NZ08	1/20	0.44

▸	LNPEP	Q9UIQ6	1/20	0.44

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
SCHEMBL7398560	0.92	MMP3 (0.54)	MMP3MMP2MMP1CPA1CPA2
SCHEMBL7391699	0.89	MMP3 (0.69)	MMP3MMP2MMP1CPA1CPA2
SCHEMBL8858199	0.87	MMP3 (0.54)	MMP3MMP2MMP1CPA1CPA2
SCHEMBL7374189	0.73	MMP3 (0.52)	MMP3MMP2MMP1CPA1CPA2
SCHEMBL6203155	0.66	MMP3 (0.75)	MMP3MMP2MMP1CPA1CPA2
SCHEMBL11765562	0.65	MMP3 (0.58)	MMP3MMP2MMP1CPA1CPA2
SCHEMBL11765572	0.65	MMP3 (0.58)	MMP3MMP2MMP1CPA1CPA2
SCHEMBL6203160	0.64	MMP3 (0.69)	MMP3MMP2MMP1CPA1CPA2
SCHEMBL9506080	0.64	MMP3 (0.67)	MMP3MMP2MMP1
SCHEMBL9506066	0.64	MMP3 (0.67)	MMP3MMP2MMP1

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
EP-0623143-A1	SUBSTITUTED PHOSPHINIC ACID-CONTAINING PEPTIDYL DERIVATIVES AS ANTIDEGENERATIVE AGENTS	MERCK & CO. INC. (US)	1994-11-09	—	—	EP	disclosed
WO-1993014112-A1	SUBSTITUTED PHOSPHINIC ACID-CONTAINING PEPTIDYL DERIVATIVES AS ANTIDEGENERATIVE AGENTS	MERCK & CO., INC. (US)	1993-07-22	—	—	WO	disclosed