SCHEMBL28536175

SCHEMBL28536175

CCC(=O)OCC(Cn1c(=O)[nH]c(=O)[nH]c1=O)OC(=O)CC

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
CYP2C19 P33261 2/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
BLM P54132 1/20 0.34
WRN Q14191 1/20 0.34
HIF1A Q16665 1/20 0.34
GAA P10253 1/20 0.33
PRKCA P17252 2/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCD Q05655 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL8592751 0.83 ALDH1A1 (0.39) ALDH1A1LMNACYP2C19CYP1A2HPGD
SCHEMBL76782 0.74 ALDH1A1 (0.55) ALDH1A1LMNACYP2C19PRKCAPRKCE
SCHEMBL5308587 0.74 ALDH1A1 (0.55) ALDH1A1LMNACYP2C19PRKCAPRKCE
SCHEMBL10602750 0.72 GAA (0.57) ALDH1A1LMNACYP2C19CYP1A2HPGD
SCHEMBL8544738 0.72 TP53 (0.45) ALDH1A1LMNACYP2C19CYP1A2HPGD
SCHEMBL8546480 0.72 TP53 (0.45) ALDH1A1LMNACYP2C19CYP1A2HPGD
SCHEMBL15198874 0.70 ALDH1A1 (0.47) ALDH1A1LMNACYP2C19PRKCAPRKCE
SCHEMBL27734483 0.70 ALDH1A1 (0.64) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL10602755 0.70 APEX1 (0.31)
SCHEMBL17877418 0.69 ALDH1A1 (0.50) ALDH1A1LMNACYP2C19GAAPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108350146-B Epoxy resin composition containing long-chain alkylene group 日产化学工业株式会社 2021-03-16 CN disclosed