SCHEMBL7523992

SCHEMBL7523992

COc1cc(C=C(C(C)=O)C(C)=O)ccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 1.00
TDP1 Q9NUW8 3/20 0.76
GAA P10253 2/20 0.76
GLO1 Q04760 5/20 0.68
ABL1 P00519 1/20 0.68
IKBKB O14920 1/20 0.63
CHUK O15111 1/20 0.63
IKBKG Q9Y6K9 1/20 0.63
APP P05067 2/20 0.62
ALDH1A1 P00352 2/20 0.62
HPGD P15428 2/20 0.62
TRIM24 O15164 1/20 0.62
ALDH5A1 P51649 1/20 0.62
ABAT P80404 1/20 0.62
TRIM33 Q9UPN9 1/20 0.62
SNCA P37840 4/20 0.59
CYP2D6 P10635 3/20 0.59
CYP1A2 P05177 2/20 0.59
ALOX5 P09917 2/20 0.59
NFKB1 P19838 2/20 0.59

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
SCHEMBL5597360 0.92 MAPT (0.85) MAPTTDP1GAAGLO1ABL1
SCHEMBL12394170 0.92 MAPT (0.85) MAPTTDP1GAAGLO1ABL1
SCHEMBL2252350 0.92 MAPT (0.85) MAPTTDP1GAAGLO1ABL1
SCHEMBL10821709 0.91 MAPT (0.83) MAPTTDP1GAAGLO1ABL1
SCHEMBL19432109 0.91 MAPT (0.83) MAPTTDP1GAAGLO1ABL1
SCHEMBL14606830 0.87 MAPT (0.76) MAPTTDP1GAAGLO1ABL1
SCHEMBL28552784 0.87 MAPT (0.77) MAPTTDP1GAAGLO1ABL1
SCHEMBL12369716 0.87 MAPT (0.77) MAPTTDP1GAAGLO1ABL1
SCHEMBL2213640 0.87 MAPT (0.77) MAPTTDP1GAAGLO1ABL1
SCHEMBL9106681 0.86 GAA (1.00) MAPTTDP1GAAGLO1IKBKB

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
US-20020174491-A1 Process for stabilizing the whiteness of lignin-containing fibrous materials, stabilizer composition and fibrous materials stabilized with this DEGUSSA-AG (DE) 2002-11-28 US disclosed
EP-1241296-A2 Process for stabilizing brightness of lignin-containing fibrous material, a composition for stabilizing the brightness thereof and thus stabilized fibrous material Degussa AG (DE) 2002-09-18 EP disclosed