SCHEMBL1576915

SCHEMBL1576915

Cn1cc(C2=NOCCS2)cn1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.33
DYRK1A Q13627 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PI4KA P42356 1/20 0.33
PIK3CG P48736 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
BRD4 O60885 1/20 0.33
FYN P06241 6/20 0.32
CHEK1 O14757 1/20 0.32
AURKA O14965 2/20 0.32
AURKB Q96GD4 2/20 0.32
INCENP Q9NQS7 2/20 0.32
EPHX2 P34913 1/20 0.32
TTK P33981 1/20 0.32
PIM1 P11309 2/20 0.31
FLT3 P36888 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL15843067 0.74 LMNA (0.36) LRRK2DYRK1APIK3CDPIK3CAPIK3CB
SCHEMBL10750163 0.68 MAPT (0.37)
SCHEMBL10752085 0.67 ALDH1A1 (0.32)
SCHEMBL15842803 0.64 DYRK1A (0.33) DYRK1APIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL8021934 0.63 AHR (0.42)
SCHEMBL15843048 0.61 FYN (0.33) LRRK2DYRK1APIK3CDPIK3CAPIK3CB
SCHEMBL27038878 0.61 AURKA (0.41) DYRK1APIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL2035062 0.60 CHEK1 (0.50) DYRK1ABRD4FYNCHEK1EPHX2
SCHEMBL15842528 0.60 KCNH2 (0.40) LRRK2BRD4AURKAAURKBINCENP
SCHEMBL1032066 0.60 MKNK1 (0.44) LRRK2DYRK1APIK3CDPIK3CAPIK3CB

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
WO-2011039276-A1 OXATHIAZINYL(HET)ARYLSULFONYLUREAS, PROCESSES AND INTERMEDIATES FOR PREPARATION THEREOF AND USE THEREOF AS CROP PROTECTION AGENTS AND CROP GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2011-04-07 WO disclosed
WO-2011039276-A1 OXATHIAZINYL(HET)ARYLSULFONYLUREAS, PROCESSES AND INTERMEDIATES FOR PREPARATION THEREOF AND USE THEREOF AS CROP PROTECTION AGENTS AND CROP GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2011-04-07 WO disclosed