SCHEMBL8918311

SCHEMBL8918311

CCOC(=O)CC([O])(OCC)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
ALDH1A1 P00352 3/20 0.44
TRPA1 O75762 1/20 0.44
CYP1A2 P05177 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
ALOX15 P16050 1/20 0.37
SOAT1 P35610 1/20 0.37
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
HSD11B1 P28845 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL8918544 0.90 GAA (0.43) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL407625 0.79 GAA (0.50) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL10595181 0.77 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28373015 0.76 GAA (0.46) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL2836974 0.74 GAA (0.44) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL4440571 0.74 GAA (0.44) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL21052480 0.73 GAA (0.55) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL232993 0.73 GAA (0.55) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL798062 0.73 GAA (0.55) GAAMGAMSIMGAM2ALDH1A1
Ammonia Solution, Strong SCHEMBL11162445 0.72 GAA (0.43) GAAMGAMSIMGAM2ALDH1A1

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
US-5620944-A PRE- AND POST-EMERGENT WEED CONTROL NIHON NOHYAKU CO., LTD. (JP) 1997-04-15 US disclosed
EP-0590834-B1 Phenylimidazole derivatives, processes for production thereof, herbicides comprising said derivatives, and usages of said herbicides NIHON NOHYAKU CO LTD (JP) 1996-12-11 EP disclosed
EP-0590834-A1 Phenylimidazole derivatives, processes for production thereof, herbicides comprising said derivatives, and usages of said herbicides NIHON NOHYAKU CO., LTD. (JP) 1994-04-06 EP disclosed