SCHEMBL5712940

SCHEMBL5712940

CCOc1ccc(Oc2ccccc2OC)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.73
MAPK1 P28482 2/20 0.73
ALDH1A1 P00352 1/20 0.73
HTT P42858 1/20 0.73
LTA4H P09960 2/20 0.62
SLC6A2 P23975 1/20 0.58
SLC6A4 P31645 1/20 0.58
SLC6A3 Q01959 1/20 0.58
NQO1 P15559 1/20 0.54
MAPT P10636 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
TP53 P04637 2/20 0.51
RAB9A P51151 2/20 0.51
MTNR1B P49286 1/20 0.51
NPC1 O15118 1/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA7 P43166 1/20 0.50

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
1,2-Dimethoxybenzene SCHEMBL20656736 0.86 LTA4H (0.63) L3MBTL1MAPK1ALDH1A1HTTLTA4H
SCHEMBL3627857 0.85 HTT (1.00) L3MBTL1MAPK1ALDH1A1HTTLTA4H
SCHEMBL14191209 0.81 ALDH1A1 (0.91) L3MBTL1MAPK1ALDH1A1HTTLTA4H
SCHEMBL1682169 0.81 HTT (0.73) L3MBTL1MAPK1ALDH1A1HTTSLC6A2
SCHEMBL31460934 0.79 ALDH1A1 (0.66) L3MBTL1ALDH1A1LTA4HSLC6A2SLC6A4
1-Methoxy-2-Ethoxybenzene SCHEMBL194473 0.79 CA12 (0.65) L3MBTL1MAPK1ALDH1A1MAPTSMN1; SMN2
SCHEMBL791852 0.79 HTT (0.86) L3MBTL1MAPK1ALDH1A1HTTLTA4H
1,2-Diethoxybenzene SCHEMBL10335108 0.79 CA12 (0.65) L3MBTL1MAPK1ALDH1A1MAPTSMN1; SMN2
SCHEMBL11738087 0.78 LTA4H (0.63) L3MBTL1MAPK1ALDH1A1HTTLTA4H
SCHEMBL29377831 0.78 HTT (0.83) L3MBTL1MAPK1ALDH1A1HTTLTA4H

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0873880-B2 Thermally-responsive record material using an ether sensitizer APPLETON PAPER INC (US) 2006-12-20 EP disclosed
EP-0873880-B1 Thermally-responsive record material using an ether sensitizer APPLETON PAPER INC (US) 2000-05-31 EP disclosed