Dimethyl Maleate

Dimethyl Maleate

SCHEMBL27705208

COC(=O)/C=C\C(=O)OC.O=C1CCCN1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

KEAP1

The experimentally established mechanism targets of Dimethyl Maleate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 known ✓ Q14145 1/20 0.48
OR51E2 Q9H255 1/20 0.56
CRBN Q96SW2 2/20 0.48
FKBP5 Q13451 1/20 0.48
NFE2L2 Q16236 4/20 0.48
HCAR2 Q8TDS4 2/20 0.48
TSHR P16473 1/20 0.39
KDM4E B2RXH2 5/20 0.36
GAA P10253 2/20 0.36
POLB P06746 1/20 0.36
HTT P42858 2/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
TYR P14679 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33

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
Monomethyl Fumarate SCHEMBL11316342 0.93 HCAR2 (0.55) OR51E2CRBNFKBP5NFE2L2HCAR2
Monomethyl Fumarate SCHEMBL11316349 0.93 HCAR2 (0.55) OR51E2CRBNFKBP5NFE2L2HCAR2
Acrylic Acid Methyl Ester SCHEMBL4203174 0.86 OR51E2 (0.52) OR51E2CRBNFKBP5NFE2L2HCAR2
2-Pyrrolidone SCHEMBL5282378 0.82 OR51E2 (0.62) OR51E2CRBNFKBP5TSHRKDM4E
2-Pyrrolidone SCHEMBL28253020 0.82 OR51E2 (0.62) OR51E2CRBNFKBP5TSHRKDM4E
Caprolactam SCHEMBL28309060 0.80 CRBN (0.52) OR51E2CRBNFKBP5TSHRKDM4E
2-Pyrrolidone SCHEMBL17698402 0.78 OR51E2 (0.75) OR51E2CRBNFKBP5TSHRKDM4E
2-Pyrrolidone SCHEMBL1436788 0.77
Fumaric Acid SCHEMBL9716900 0.76 OR51E2 (0.65) OR51E2CRBNFKBP5TSHRKDM4E
Fumaric Acid SCHEMBL9716897 0.76 OR51E2 (0.65) OR51E2CRBNFKBP5TSHRKDM4E

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
CN-101849209-B Composition for forming top anti-reflection film and pattern forming method using the same AZ ELECTRONIC MATERIALS JAPAN 2012-11-28 CN disclosed
CN-101849209-A Composition for forming top anti-reflection film and pattern forming method using the same AZ ELECTRONIC MATERIALS JAPAN 2010-09-29 CN disclosed
CN-100587600-C Composition for antireflection coating and pattern formation method using the same DAINIPPON INK & CHEMICALS 2010-02-03 CN disclosed
CN-101031846-A Composition for antireflection coating and pattern formation method using the same DAINIPPON INK & CHEMICALS (JP) 2007-09-05 CN disclosed