SCHEMBL8918318

SCHEMBL8918318

CCOCCOCCOC(=O)CCO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
TSHR P16473 1/20 0.54
THRB P10828 1/20 0.47
DGKA P23743 1/20 0.45
EPHX2 P34913 2/20 0.43
HSD17B10 Q99714 1/20 0.42
CYP4F2 P78329 3/20 0.42
CYP4A11 Q02928 3/20 0.42
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
ADRA2A P08913 1/20 0.39
ADRA1A P35348 1/20 0.39
MAPT P10636 1/20 0.38
BLM P54132 1/20 0.38
MGLL Q99685 1/20 0.37
CYP1A2 P05177 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL2303872 0.89 ALDH1A1 (0.60) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL3879046 0.89 ALDH1A1 (0.60) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL1301905 0.87 ALDH1A1 (0.62) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL7171800 0.86 DGKA (0.53) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL4250044 0.85 DGKA (0.63) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL181434 0.85 ALDH1A1 (0.56) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL17998753 0.85 DGKA (0.63) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL821877 0.85 MEN1 (0.52) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL10591018 0.84 DGKA (0.57) ALDH1A1TSHRTHRBDGKAEPHX2
SCHEMBL8918555 0.83 DGKA (0.41) ALDH1A1TSHRDGKAEPHX2HSD17B10

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