SCHEMBL29050757

SCHEMBL29050757

[O]CCOCC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
KMT2A Q03164 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
HPGD P15428 3/20 0.50
MEN1 O00255 3/20 0.50
MAPK1 P28482 2/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP3A4 P08684 1/20 0.50
ALOX15 P16050 1/20 0.50
CES1 P23141 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
GSK3B P49841 2/20 0.47
PTPN1 P18031 2/20 0.47
TRPA1 O75762 1/20 0.47
HIF1A Q16665 1/20 0.47
L3MBTL1 Q9Y468 5/20 0.46
NPC1 O15118 5/20 0.46

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
SCHEMBL864716 0.85 MAPT (0.61) MAPTKMT2ATDP1HPGDMEN1
SCHEMBL11617258 0.84 TDP1 (0.55) MAPTKMT2ATDP1HPGDMEN1
SCHEMBL27830157 0.84 L3MBTL1 (0.50) MAPTKMT2ATDP1HPGDMEN1
SCHEMBL2126591 0.82 LMNA (0.56) MAPTKMT2ATDP1HPGDMEN1
SCHEMBL28061828 0.82 MAPK1 (0.55) MAPTKMT2ATDP1HPGDMEN1
SCHEMBL7376345 0.81 TDP1 (0.55) MAPTKMT2ATDP1HPGDMEN1
SCHEMBL1742078 0.79 TSHR (0.49) MAPTKMT2ATDP1HPGDMEN1
SCHEMBL10665429 0.79 ALDH1A1 (0.52) MAPTKMT2ATDP1HPGDMEN1
SCHEMBL7044825 0.79 GSK3B (0.52) MAPTKMT2ATDP1HPGDMEN1
Biphenyl SCHEMBL9787041 0.79 L3MBTL1 (0.58) MAPTKMT2ATDP1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116589793-A Anti-aging polypropylene cable material and preparation method and application thereof 江苏多上新材料科技有限公司 2023-08-15 CN claimed
CN-116589793-B Anti-aging polypropylene cable material and preparation method and application thereof 江苏多上新材料科技有限公司 2024-05-17 CN disclosed
CN-116589793-A Anti-aging polypropylene cable material and preparation method and application thereof 江苏多上新材料科技有限公司 2023-08-15 CN disclosed