SCHEMBL29249309

SCHEMBL29249309

O=C(O)CC(=O)c1ccc(C(=O)CC(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.62
MEN1 O00255 2/20 0.62
CYP3A4 P08684 2/20 0.62
HPGD P15428 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
MAPK1 P28482 2/20 0.62
KDM4E B2RXH2 1/20 0.62
MAPT P10636 1/20 0.62
ALOX15 P16050 1/20 0.62
CES1 P23141 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
RAB9A P51151 2/20 0.54
NPC1 O15118 1/20 0.54
ERCC5 P28715 4/20 0.52
FEN1 P39748 4/20 0.52
PTPN1 P18031 3/20 0.52
HAO1 Q9UJM8 3/20 0.50
HIF1A Q16665 3/20 0.48
CYP1A2 P05177 2/20 0.48
PLOD2 O00469 2/20 0.48

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
SCHEMBL9352579 0.92 TSHR (0.60) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL2715371 0.90 PTPN1 (0.58) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL98540 0.89 KMT2A (0.80) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL904555 0.88 PLOD2 (0.62) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL4426537 0.88 TPMT (0.56) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL4842224 0.88 NPC1 (0.73) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL9218784 0.88 MAPT (0.57) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL2635792 0.88 HAO1 (0.63) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL4716770 0.88 ERCC5 (0.70) KMT2AMEN1CYP3A4HPGDSMN1; SMN2
SCHEMBL527869 0.87 KMT2A (0.76) KMT2AMEN1CYP3A4HPGDSMN1; SMN2

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-118324097-A Working solution for synthesizing hydrogen peroxide by anthraquinone method 中国石油化工股份有限公司 2024-07-12 CN claimed
CN-117945351-A Working solution for producing hydrogen peroxide by anthraquinone process 中国石油化工股份有限公司 2024-04-30 CN claimed
CN-118324097-A Working solution for synthesizing hydrogen peroxide by anthraquinone method 中国石油化工股份有限公司 2024-07-12 CN disclosed