SCHEMBL7337403

SCHEMBL7337403

COC(=O)CN[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.60
MMP2 P08253 1/20 0.57
MMP7 P09237 1/20 0.57
MMP9 P14780 1/20 0.57
MMP12 P39900 1/20 0.57
MMP13 P45452 1/20 0.57
ACE P12821 3/20 0.56
CPA1 P15085 1/20 0.56
ACE2 Q9BYF1 1/20 0.56
MMP1 P03956 2/20 0.55
REN P00797 2/20 0.53

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL7595012 0.90 MMP1 (0.66) MMP2MMP7MMP9MMP12MMP13
SCHEMBL7374244 0.88 MME (0.57) MMEMMP2MMP7MMP9MMP12
SCHEMBL10662173 0.86 MME (0.58) MMEMMP2MMP7MMP9MMP12
SCHEMBL7344017 0.86 MME (0.55) MMEMMP2MMP7MMP9MMP12
SCHEMBL3910340 0.85 MME (0.66) MMEMMP2MMP7MMP9MMP12
SCHEMBL17026706 0.85 MME (0.66) MMEMMP2MMP7MMP9MMP12
SCHEMBL10932308 0.85 MME (0.66) MMEMMP2MMP7MMP9MMP12
SCHEMBL8390276 0.83 MME (0.68) MMEMMP2MMP7MMP9MMP12
SCHEMBL15649671 0.83 MME (0.67) MMEMMP2MMP7MMP9MMP12
SCHEMBL15692372 0.83 MME (0.67) MMEMMP2MMP7MMP9MMP12

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0844877-A1 USE OF OXIDO-SQUALENE CYCLASE INHIBITORS TO LOWER BLOOD CHOLESTEROL ZENECA LIMITED (GB) 1998-06-03 EP disclosed
EP-0826000-A1 PEPTIDE COMPOUNDS WHICH INHIBIT METALLOPROTEINASE AND TNF LIBERATION AND THEIR THERAPEUTIC USES Chiroscience Limited (GB) 1998-03-04 EP disclosed
EP-0783500-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1997-07-16 EP disclosed
WO-1997006802-A1 USE OF OXIDO-SQUALENE CYCLASE INHIBITORS TO LOWER BLOOD CHOLESTEROL ZENECA LIMITED (GB) 1997-02-27 WO disclosed
WO-1996035714-A1 PEPTIDE COMPOUNDS WHICH INHIBIT METALLOPROTEINASE AND TNF LIBERATION AND THEIR THERAPEUTIC USES CHIROSCIENCE LIMITED (GB) 1996-11-14 WO disclosed
WO-1996010022-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1996-04-04 WO disclosed