SCHEMBL30142226

SCHEMBL30142226

O=C1NCc2cc3c(cc21)OCO3

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.69
ACHE P22303 1/20 0.46
ALOX5 P09917 1/20 0.44
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
CLK4 Q9HAZ1 3/20 0.42
NTRK2 Q16620 2/20 0.42
DYRK1B Q9Y463 2/20 0.42
TYRO3 Q06418 1/20 0.42
NTRK1 P04629 2/20 0.41
FLT3 P36888 2/20 0.41
GSK3B P49841 2/20 0.41
JAK2 O60674 1/20 0.41
MET P08581 1/20 0.41
FGFR1 P11362 1/20 0.41
PRKACA P17612 1/20 0.41
KDR P35968 1/20 0.41
MAP2K2 P36507 1/20 0.41
MAP2K1 Q02750 1/20 0.41
MST1R Q04912 1/20 0.41

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
Noroxyhydrastinine SCHEMBL29745981 0.81 KDM4E (1.00) KDM4EACHEGRM5CYP2D6PARP1
Noroxyhydrastinine SCHEMBL564339 0.81 KDM4E (1.00) KDM4EACHEGRM5CYP2D6PARP1
SCHEMBL28893845 0.79 CA12 (0.56) KDM4ECA12CA9CLK4NTRK2
SCHEMBL32666530 0.77 CA12 (0.54) KDM4ECA12CA9CLK4NTRK2
SCHEMBL25028954 0.77 KDM4E (0.42) KDM4ECA12CA9CLK4NTRK2
SCHEMBL29397030 0.77 KDM4E (0.42) KDM4ECA12CA9CLK4NTRK2
SCHEMBL7283744 0.73 KDM4E (0.53) KDM4EACHEDYRK1BGSK3BALDH1A1
SCHEMBL1079809 0.69 CLK4 (0.51) CA12CA9CLK4NTRK2DYRK1B
SCHEMBL15680247 0.69 CA12 (0.47) ACHECA12CA9CLK4NTRK2
SCHEMBL10139776 0.69 HTT (0.52) CA12CA9CLK4NTRK2DYRK1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4384523-A1 2,2-DIFLUORO-5H-[1,3]DIOXOLO[4,5-F]ISOINDOL-7-ONE DERIVATIVES AS PESTICIDES Syngenta Crop Protection AG (CH) 2024-06-19 EP disclosed
WO-2023017094-A1 2,2-DIFLUORO-5H-[1,3]DIOXOLO[4,5-F]ISOINDOL-7-ONE DERIVATIVES AS PESTICIDES SYNGENTA CROP PROTECTION AG (CH) 2023-02-16 WO disclosed