SCHEMBL28352138

SCHEMBL28352138

COC(=O)C(=CO)OC.[NaH]

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
TET2 Q6N021 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
ATP6V1B1 P15313 1/20 0.30

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
SCHEMBL6168638 0.97
SCHEMBL6168640 0.97
SCHEMBL9846205 0.78
SCHEMBL9846201 0.78
SCHEMBL13711309 0.77
SCHEMBL4903558 0.77
SCHEMBL8385948 0.77
SCHEMBL7030375 0.74
SCHEMBL7030376 0.74
SCHEMBL10780935 0.74 ALDH1A1 (0.39) ALDH1A1KEAP1NFE2L2HCAR2

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-110759829-A Synthesis method of 3-hydroxy-2-methoxy methyl acrylate sodium salt 江苏快达农化股份有限公司 2020-02-07 CN claimed
CN-110759829-A Synthesis method of 3-hydroxy-2-methoxy methyl acrylate sodium salt 江苏快达农化股份有限公司 2020-02-07 CN disclosed
CN-110759829-A Synthesis method of 3-hydroxy-2-methoxy methyl acrylate sodium salt 江苏快达农化股份有限公司 2020-02-07 CN disclosed
CN-110759829-A Synthesis method of 3-hydroxy-2-methoxy methyl acrylate sodium salt 江苏快达农化股份有限公司 2020-02-07 CN disclosed