SCHEMBL6661430

SCHEMBL6661430

CCC(=O)N[C@@H](CCC(=O)N[C@@H](CSC(=O)CC)C(=O)NCC(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 5/20 0.54
▸ PTGS1 P23219 1/20 0.46
▸ GSTK1 Q9Y2Q3 1/20 0.46
▸ NOD1 Q9Y239 4/20 0.45
▸ GLP1R P43220 8/20 0.41
▸ EPHX2 P34913 1/20 0.38

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
SCHEMBL6662211 0.93 GLO1 (0.52) GLO1PTGS1GSTK1NOD1GLP1R
SCHEMBL6660268 0.90 GLO1 (0.49) GLO1PTGS1GSTK1NOD1GLP1R
SCHEMBL30565118 0.85 NOD1 (0.61) GLO1NOD1GLP1REPHX2
SCHEMBL30565116 0.85 NOD1 (0.61) GLO1NOD1GLP1REPHX2
SCHEMBL6665444 0.82 PTGS1 (0.67) GLO1PTGS1GSTK1NOD1GLP1R
SCHEMBL6662380 0.81 GLO1 (0.50) GLO1PTGS1GSTK1NOD1
SCHEMBL11864999 0.81 PTGS1 (0.62) GLO1PTGS1GSTK1NOD1
SCHEMBL20122686 0.81 NOD1 (0.52) GLO1NOD1GLP1REPHX2
SCHEMBL9007853 0.79 PTGS1 (0.62) GLO1PTGS1GSTK1NOD1
SCHEMBL9007859 0.79 PTGS1 (0.62) GLO1PTGS1GSTK1NOD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147452-A1 Non-amphoteric glutathione derivative compositions for tropical application YU RUEY J 2004-07-29 — — US claimed
WO-2004010968-A1 NON-AMPHOTERIC GLUTATHIONE DERIVATIVE COMPOSITIONS FOR TOPICAL APPLICATION YU RUEY J (US) 2004-02-05 — — WO claimed
US-20040147452-A1 Non-amphoteric glutathione derivative compositions for tropical application YU RUEY J 2004-07-29 — — US disclosed
WO-2004010968-A1 NON-AMPHOTERIC GLUTATHIONE DERIVATIVE COMPOSITIONS FOR TOPICAL APPLICATION YU RUEY J (US) 2004-02-05 — — WO disclosed
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