SCHEMBL6662211

SCHEMBL6662211

CCC(=O)SC[C@H](NC(=O)CC[C@H](NC(C)=O)C(=O)O)C(=O)NCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 5/20 0.52
▸ PTGS1 P23219 1/20 0.44
▸ GSTK1 Q9Y2Q3 1/20 0.44
▸ NOD1 Q9Y239 3/20 0.43
▸ FOLH1 Q04609 1/20 0.41
▸ GLP1R P43220 8/20 0.40

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
SCHEMBL6661430 0.93 GLO1 (0.54) GLO1PTGS1GSTK1NOD1GLP1R
SCHEMBL6662380 0.89 GLO1 (0.50) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL14597271 0.87 GLO1 (0.49) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL6660268 0.86 GLO1 (0.49) GLO1PTGS1GSTK1NOD1GLP1R
SCHEMBL30565118 0.83 NOD1 (0.61) GLO1NOD1GLP1R
SCHEMBL30565116 0.83 NOD1 (0.61) GLO1NOD1GLP1R
SCHEMBL4101591 0.82 GLO1 (0.46) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL19177854 0.81 PTGS1 (0.55) GLO1PTGS1GSTK1NOD1
SCHEMBL20787749 0.80 PTGS1 (0.67) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL30662152 0.80 GLO1 (0.50) GLO1PTGS1GSTK1NOD1FOLH1

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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