SCHEMBL13359394

SCHEMBL13359394

Cc1cc(Cc2ccc(OC(=O)c3ccc(C=O)cc3)c(C)c2)ccc1O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
AOX1 Q06278 1/20 0.38
TRIM24 O15164 1/20 0.38
HPGD P15428 1/20 0.38
ALDH5A1 P51649 1/20 0.38
ABAT P80404 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
PTPN1 P18031 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL12850101 0.87 ALDH1A1 (0.46) ESR1ESR2ALDH1A1KDM4EMAPT
SCHEMBL12710619 0.84 ESR1 (0.49) ESR1ALDH1A1KDM4EMAPTAOX1
SCHEMBL12710147 0.83 ALDH1A1 (0.54) ALDH1A1KDM4EMAPTAOX1TRIM24
SCHEMBL12521518 0.81 ESR1 (0.46) ESR1ALDH1A1KDM4EMAPTAOX1
SCHEMBL12520031 0.80 ALDH1A1 (0.51) ALDH1A1KDM4EMAPTAOX1TRIM24
SCHEMBL9887003 0.79 ESR1 (0.43) ESR1ALDH1A1KDM4EMAPTTDP1
SCHEMBL12710350 0.78 ESR1 (0.55) ESR1ESR2ALDH1A1KDM4EMAPT
SCHEMBL12710495 0.78 ESR1 (0.43) ESR1ALDH1A1KDM4EMAPTAOX1
SCHEMBL9887004 0.78 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTTHRBMEN1
SCHEMBL15443898 0.78 ESR1 (0.62) ESR1ESR2ALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718337-B2 Electrophotographic photoreceptor MITSUBISHI CHEMICAL CORPORATION (JP) 2010-05-18 US disclosed
US-20090081570-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR MITSUBISHI CHEMICAL CORPORATION (JP) 2009-03-26 US disclosed
US-7473507-B2 Electrophotographic photoreceptor with polyester resin in photosensitive layer MITSUBISHI CHEMICAL CORPORATION (JP) 2009-01-06 US disclosed
US-7244535-B2 Electrophotographic photoreceptor MITSUBISHI CHEMICAL CORPORATION (JP) 2007-07-17 US disclosed