SCHEMBL3262355

SCHEMBL3262355

COc1ccc(C(O)CC(F)(F)F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.54
GAA P10253 1/20 0.48
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
IGF1R P08069 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR1A P08908 3/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL6831554 0.80 AOC3 (0.57) AOC3GAAALDH1A1MAPTL3MBTL1
SCHEMBL20644495 0.79 PTPN5 (0.40) AOC3ALDH1A1MEN1KMT2ACYP2D6
SCHEMBL28028701 0.79 AOC3 (0.59) AOC3GAAALDH1A1MAPTL3MBTL1
SCHEMBL24015547 0.79 ALDH1A1 (0.40) AOC3ALDH1A1MAPTTSHRTDP1
SCHEMBL327629 0.78 AOC3 (0.63) AOC3GAAALDH1A1MAPTL3MBTL1
SCHEMBL7932298 0.78 ALDH1A1 (0.48) AOC3GAAALDH1A1MAPTL3MBTL1
SCHEMBL2517919 0.76 AOC3 (0.61) AOC3GAAALDH1A1MAPTL3MBTL1
SCHEMBL17660055 0.76 AOC3 (0.61) AOC3GAAALDH1A1MAPTL3MBTL1
SCHEMBL4372787 0.76 AOC3 (0.61) AOC3GAAALDH1A1MAPTL3MBTL1
SCHEMBL615718 0.76 AOC3 (0.61) AOC3GAAALDH1A1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010030787-A1 ESTROGEN RECEPTOR LIGANDS RADIUS HEALTH, INC. (US) 2010-03-18 WO disclosed