SCHEMBL8920157

SCHEMBL8920157

CCOCCOC(=O)COC=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
TSHR P16473 3/20 0.50
THRB P10828 2/20 0.44
HSD17B10 Q99714 3/20 0.38
DGKA P23743 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
EPHX2 P34913 1/20 0.33
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
NAAA Q02083 1/20 0.31
TRPA1 O75762 1/20 0.30

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
SCHEMBL8919017 0.98 ALDH1A1 (0.48) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL8918949 0.83 ALDH1A1 (0.48) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL8918469 0.83 TSHR (0.35) ALDH1A1TSHRHSD17B10TP53HIF1A
SCHEMBL3364080 0.82 HCAR2 (0.41) ALDH1A1TSHRDGKASMN1; SMN2HPGD
SCHEMBL8919608 0.81 ALDH1A1 (0.47) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL1100419 0.81
SCHEMBL780053 0.81 ALDH1A1 (0.60) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL8918103 0.80 TSHR (0.37) TSHRDGKASMN1; SMN2
SCHEMBL17974553 0.79 ALDH1A1 (0.58) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL3364135 0.78 ATM (0.50) ALDH1A1TSHRDGKAHPGDTDP1

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