SCHEMBL8919708

SCHEMBL8919708

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PKM P14618 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 2/20 0.40
ALOX15 P16050 1/20 0.40
MGAM O43451 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
SOAT1 P35610 1/20 0.40
CYP4F2 P78329 3/20 0.39
CYP4A11 Q02928 3/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.38
PIN1 Q13526 1/20 0.37
MMP8 P22894 1/20 0.37
TRPA1 O75762 1/20 0.37

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
SCHEMBL8920669 0.89 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10PKMMEN1
SCHEMBL788715 0.77 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10PKMMEN1
SCHEMBL5936809 0.75 ALDH1A1 (0.43) ALDH1A1LMNAHSD17B10PKMMEN1
SCHEMBL6507050 0.75 CYP4F2 (0.48) ALDH1A1LMNAHSD17B10PKMMEN1
SCHEMBL5469810 0.75 CYP4F2 (0.44) ALDH1A1LMNAHSD17B10PKMMEN1
SCHEMBL195662 0.75 CYP4F2 (0.56) ALDH1A1LMNAHSD17B10PKMMEN1
SCHEMBL637901 0.74
SCHEMBL27793139 0.73 CYP4F2 (0.42) ALDH1A1LMNAHSD17B10PKMMEN1
SCHEMBL6761656 0.73 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10PKMMEN1
SCHEMBL27603424 0.73 MEN1 (0.44) ALDH1A1LMNAHSD17B10PKMMEN1

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