SCHEMBL4673885

SCHEMBL4673885

CCN(CC)C(=O)C(=O)CSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 5/20 0.59
PTGS1 P23219 1/20 0.57
GSTK1 Q9Y2Q3 1/20 0.57
NOD1 Q9Y239 7/20 0.41
FOLH1 Q04609 1/20 0.37

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
SCHEMBL4674407 0.90 GLO1 (0.65) GLO1PTGS1GSTK1NOD1FOLH1
Bromide SCHEMBL4678820 0.89 GLO1 (0.64) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL11877037 0.87 GLO1 (0.61) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL11877051 0.87 GLO1 (0.61) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL4675496 0.86 PTGS1 (0.65) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL4158575 0.85 PTGS1 (0.68) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL4158582 0.85 PTGS1 (0.68) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL4675137 0.85 PTGS1 (0.59) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL11864018 0.84 PTGS1 (0.67) GLO1PTGS1GSTK1NOD1FOLH1
SCHEMBL11864029 0.84 PTGS1 (0.67) 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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392639-B1 PYRUVATE DERIVATIVES GALILEO LAB INC (US) 2008-09-17 EP claimed
US-6916850-B2 Pyruvate derivatives GALILEO PHARMACEUTICALS, INC. (US) 2005-07-12 US claimed
US-20030013846-A1 Pyruvate derivatives ALLOY VENTURES, INC. 2003-01-16 US claimed
US-20030013656-A1 Pyruvate derivatives ALLOY VENTURES, INC. 2003-01-16 US claimed
EP-1392639-B1 PYRUVATE DERIVATIVES GALILEO LAB INC (US) 2008-09-17 EP disclosed
EP-1392639-B1 PYRUVATE DERIVATIVES GALILEO LAB INC (US) 2008-09-17 EP disclosed
EP-1392639-A4 PYRUVATE DERIVATIVES GALILEO LAB INC (US) 2006-01-25 EP disclosed
US-6916850-B2 Pyruvate derivatives GALILEO PHARMACEUTICALS, INC. (US) 2005-07-12 US disclosed
US-6900218-B2 Pyruvate derivatives GALILEO PHARMACEUTICALS, INC. (US) 2005-05-31 US disclosed
EP-1392639-A1 PYRUVATE DERIVATIVES Galileo Laboratories, Inc. (US) 2004-03-03 EP disclosed
US-20030013846-A1 Pyruvate derivatives ALLOY VENTURES, INC. 2003-01-16 US disclosed
US-20030013656-A1 Pyruvate derivatives ALLOY VENTURES, INC. 2003-01-16 US disclosed
US-20030013847-A1 Cytoprotective agents MONSANTO TECHNOLOGY LLC 2003-01-16 US disclosed
US-20030013657-A1 Pyruvate derivatives MONSANTO TECHNOLOGY, LLC. 2003-01-16 US disclosed
WO-2002090314-A1 PYRUVATE DERIVATIVES GALILEO LABORATORIES, INC. (US) 2002-11-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030013847-A1 Cytoprotective agents PC, PDK1, PDK2 GLO1 245/4885PTGS1 308/4885GSTK1 66/4885
US-20030013657-A1 Pyruvate derivatives PC, PDK1, PDK4 GLO1 227/4885PTGS1 816/4885GSTK1 280/4885
US-20030013846-A1 Pyruvate derivatives PC, PDK1, PDK4 GLO1 227/4885PTGS1 816/4885GSTK1 280/4885
US-20030013656-A1 Pyruvate derivatives PC, PDK1, PDK4 GLO1 227/4885PTGS1 816/4885GSTK1 280/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.