SCHEMBL8919700

SCHEMBL8919700

COCCOCCOC(=O)CCOC=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.36
TSHR P16473 4/20 0.34
ALDH1A1 P00352 3/20 0.34
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
ADRA2A P08913 1/20 0.34
ADRA1A P35348 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
EPHX2 P34913 1/20 0.32
ABCB11 O95342 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADRA2B P18089 1/20 0.32
OPRD1 P41143 1/20 0.32
SCN5A Q14524 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL8919608 0.86 ALDH1A1 (0.47) DGKATSHRALDH1A1TP53HIF1A
SCHEMBL22662461 0.85 DGKA (0.43) DGKATSHRALDH1A1TP53HIF1A
SCHEMBL8918949 0.84 ALDH1A1 (0.48) DGKATSHRALDH1A1ADRA2AADRA1A
SCHEMBL8918469 0.84 TSHR (0.35) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL13268865 0.82 ADRA2A (0.48) DGKATSHRALDH1A1TP53HIF1A
SCHEMBL2302053 0.82 ADRA2A (0.48) DGKATSHRALDH1A1TP53HIF1A
SCHEMBL22510580 0.82 ADRA2A (0.48) DGKATSHRALDH1A1TP53HIF1A
SCHEMBL16062669 0.81 DGKA (0.52) DGKATSHRALDH1A1HSD17B10MAPT
SCHEMBL8917133 0.80 ADRA2A (0.31) ADRA2AADRA1AMAPTBLM
SCHEMBL12250899 0.80 DGKA (0.37) DGKATSHRALDH1A1TP53HIF1A

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