SCHEMBL4235740

SCHEMBL4235740

COCCOC(=O)CC[C@H](N)C(=O)OCCOC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.38
DGKA P23743 1/20 0.37
DDAH1 O94760 1/20 0.36
NOD1 Q9Y239 2/20 0.35
ADRA2A P08913 1/20 0.35
ADRA1A P35348 1/20 0.35
MAPT P10636 1/20 0.34
BLM P54132 1/20 0.34
TSHR P16473 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
P2RY10 O00398 4/20 0.33
GPR34 Q9UPC5 2/20 0.33
GRM8 O00222 1/20 0.32
GRM6 O15303 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GSR P00390 1/20 0.32

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
SCHEMBL17664953 0.87 DDAH1 (0.49) SLC1A1DDAH1NOD1BLMP2RY10
SCHEMBL26691732 0.87 DDAH1 (0.49) SLC1A1DDAH1NOD1BLMP2RY10
SCHEMBL6432575 0.83 DGKA (0.42) SLC1A1DGKANOD1ADRA2AADRA1A
SCHEMBL9849807 0.83 DGKA (0.42) SLC1A1DGKANOD1ADRA2AADRA1A
SCHEMBL2034669 0.83 DGKA (0.42) SLC1A1DGKANOD1ADRA2AADRA1A
SCHEMBL19472860 0.83 DDAH1 (0.46) SLC1A1DDAH1NOD1BLMP2RY10
SCHEMBL10569270 0.81 CYP19A1 (0.41) SLC1A1DGKANOD1ADRA2AADRA1A
SCHEMBL10569273 0.81 CYP19A1 (0.41) SLC1A1DGKANOD1ADRA2AADRA1A
SCHEMBL21810562 0.81 MAPT (0.38) SLC1A1DGKANOD1ADRA2AADRA1A
SCHEMBL21802404 0.81 MAPT (0.38) SLC1A1DGKANOD1ADRA2AADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1874948-B1 Process for the production of y-glutamylcysteine NEWSOUTH INNOVATIONS PTY LTD (AU) 2013-03-20 EP disclosed
US-8236533-B2 Process for the production of γ-glutamylcysteine NEWSOUTH INNOVATIONS PTY LIMITED (AU) 2012-08-07 US disclosed
US-20090136993-A1 Process for the Production of Gamma-Glutamylcysteine NEWSOUTH INNOVATIONS PTY LIMITED 2009-05-28 US disclosed
EP-1874948-A1 PROCESS FOR THE PRODUCTION OF y-GLUTAMYLCYSTEINE Newsouth Innovations Pty Limited (AU) 2008-01-09 EP disclosed
WO-2006102722-A1 PROCESS FOR THE PRODUCTION OF Ϝ-GLUTAMYLCYSTEINE NEWSOUTH INNOVATIONS PTY LIMITED (AU) 2006-10-05 WO disclosed