SCHEMBL1401796

SCHEMBL1401796

CCCCCCCCCCCCCCCCCC(N)OC(=O)C(=O)OC(N)CCCCCCCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.50
GRIK2 Q13002 2/20 0.50
SLC1A2 P43004 1/20 0.47
SLC1A1 P43005 1/20 0.47
LAP3 P28838 2/20 0.47
GPR84 Q9NQS5 3/20 0.45
SPHK1 Q9NYA1 1/20 0.45
FFAR1 O14842 1/20 0.45
ZDHHC7 Q9NXF8 1/20 0.44
MAPT P10636 1/20 0.44
TP53 P04637 1/20 0.44
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
S1PR2 O95136 5/20 0.43
S1PR1 P21453 5/20 0.43
S1PR3 Q99500 5/20 0.43
S1PR4 O95977 4/20 0.43
OPRM1 P35372 1/20 0.43

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
SCHEMBL27918872 1.00 GRIK1 (0.50) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL5968376 1.00 GRIK1 (0.50) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL27922903 1.00 GRIK1 (0.50) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL4630307 0.98 GRIK1 (0.48) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL27980592 0.88 GRIK1 (0.50) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL29131411 0.88 GRIK1 (0.50) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL1562265 0.87 TSHR (0.51) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL1562175 0.87 TSHR (0.51) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL9586888 0.87 TSHR (0.51) GRIK1GRIK2SLC1A2SLC1A1LAP3
SCHEMBL9586357 0.87 TSHR (0.51) GRIK1GRIK2SLC1A2SLC1A1LAP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2292095-A2 Pesticide compositions containing a dicarboxylic acid or derivative thereof Monsanto Technology LLC (US) 2011-03-09 EP disclosed
US-7883715-B2 Mixture containing surfactants; intensifying herbicide MONSANTO TECHNOLOGY LLC (US) 2011-02-08 US disclosed
EP-2172107-A2 Process for the preparation of a dry pesticidal composition containing a dicarboxylate component Monsanto Technology LLC (US) 2010-04-07 EP disclosed
US-7141532-B2 Process for the preparation of a dry pesticidal composition containing a dicarboxylate component MONSANTO TECHNOLOGY LLC (US) 2006-11-28 US disclosed
EP-1542533-A2 PESTICIDE COMPOSITIONS CONTAINING DICARBOXYLIC ACIDS Monsanto Technology LLC (US) 2005-06-22 EP disclosed
EP-1538910-A2 PROCESS FOR THE PREPARATION OF A DRY PESTICIDAL COMPOSITION CONTAINING A DICARBOXYLATE COMPONENT Monsanto Technology LLC (US) 2005-06-15 EP disclosed
US-20040097372-A1 Pesticide compositions containing dicarboxylic acids MONSANTO TECHNOLOGY LLC 2004-05-20 US disclosed
US-20040077499-A1 Process for the preparation of a dry pesticidal composition containing a dicarboxylate component MONSANTO TECHNOLOGY LLC 2004-04-22 US disclosed
WO-2004019681-A2 PESTICIDE COMPOSITIONS CONTAINING DICARBOXYLIC ACIDS MONSANTO TECHNOLOGY LLC (US) 2004-03-11 WO disclosed
WO-2004019684-A2 PROCESS FOR THE PREPARATION OF A DRY PESTICIDAL COMPOSITION CONTAINING A DICARBODYLATE COMPONENT MONSANTO TECHNOLOGY LLC (US) 2004-03-11 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 (1 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-20040097372-A1 Pesticide compositions containing dicarboxylic acids DPP7, CTSC, DDT GRIK1 619/4885GRIK2 454/4885SLC1A2 24/4885

“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.