SCHEMBL29035971

SCHEMBL29035971

CC(=O)OC(C)n1ccc(=O)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
HTT P42858 1/20 0.37
NR3C2 P08235 5/20 0.35
NR3C1 P04150 3/20 0.35
PGR P06401 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
RECQL P46063 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
F2 P00734 1/20 0.34
PLAU P00749 1/20 0.34
ELANE P08246 1/20 0.34
ERCC1 P07992 1/20 0.33
FEN1 P39748 1/20 0.33
ERCC4 Q92889 1/20 0.33
CCNT1 O60563 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 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
SCHEMBL28761000 0.79 CA12 (0.39) NR3C2NR3C1
SCHEMBL27611520 0.78 NR3C2 (0.37) NR3C2NR3C1ALDH1A1MAPTRECQL
SCHEMBL29742948 0.77 GAA (0.43) POLBHTTALDH1A1RAB9ASMN1; SMN2
SCHEMBL16019428 0.77 GAA (0.43) POLBHTTALDH1A1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL29744409 0.76 GAA (0.42) POLBHTTALDH1A1RAB9ASMN1; SMN2
SCHEMBL11209620 0.74 POLB (0.48) POLBHTTALDH1A1KDM4EMAPT
SCHEMBL27739462 0.73 MAPT (0.38) HTTALDH1A1MAPT
SCHEMBL7834970 0.72 ALDH1A1 (0.40) NR3C2NR3C1PGRALDH1A1MAPT
SCHEMBL1924917 0.69 NOTUM (0.62) POLBHTTALDH1A1KDM4EMAPT
SCHEMBL3083716 0.69 KMT2A (0.53) POLBHTTKDM4EMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115232070-B Quinolinone alkaloid derivative containing acylhydrazone group on 1-position nitrogen atom, and preparation method and application thereof 太原理工大学 2023-06-30 CN claimed
CN-115232070-A Quinolinone alkaloid derivative containing acylhydrazone group on 1-site nitrogen atom and preparation method and application thereof 太原理工大学 2022-10-25 CN claimed
CN-115232070-B Quinolinone alkaloid derivative containing acylhydrazone group on 1-position nitrogen atom, and preparation method and application thereof 太原理工大学 2023-06-30 CN disclosed
CN-115232070-B Quinolinone alkaloid derivative containing acylhydrazone group on 1-position nitrogen atom, and preparation method and application thereof 太原理工大学 2023-06-30 CN disclosed
CN-115232070-A Quinolinone alkaloid derivative containing acylhydrazone group on 1-site nitrogen atom and preparation method and application thereof 太原理工大学 2022-10-25 CN disclosed
CN-115232070-A Quinolinone alkaloid derivative containing acylhydrazone group on 1-site nitrogen atom and preparation method and application thereof 太原理工大学 2022-10-25 CN disclosed