SCHEMBL12866263

SCHEMBL12866263

CC1=CC(=C/C=C/c2ccc(O)c(OC=O)c2)C=C(C)O1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.47
DNMT1 P26358 1/20 0.43
TXNRD1 Q16881 2/20 0.39
NFE2L2 Q16236 3/20 0.39
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
TRIM24 O15164 1/20 0.38
ALDH5A1 P51649 1/20 0.38
ABAT P80404 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
CYP2D6 P10635 3/20 0.38
CYP1A2 P05177 2/20 0.38
ALOX5 P09917 2/20 0.38
NFKB1 P19838 2/20 0.38
HSD11B1 P28845 2/20 0.38
STAT3 P40763 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
TYR P14679 2/20 0.38

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
SCHEMBL12866317 0.81 XDH (0.49) XDHALDH1A1HPGDTDP1CYP1A2
SCHEMBL12866259 0.80 XDH (0.33) XDHDNMT1TXNRD1NFE2L2ALDH1A1
SCHEMBL12881137 0.77 PTPN1 (0.55) ALDH1A1HPGDALOX5APPCA12
SCHEMBL1012820 0.70 ALDH1A1 (0.67) XDHNFE2L2ALDH1A1HPGDTDP1
SCHEMBL12866248 0.69 XDH (0.38) XDHDNMT1TXNRD1NFE2L2ALDH1A1
SCHEMBL12866099 0.69 XDH (0.43) XDHALDH1A1HPGDKDM4EMAOB
SCHEMBL12866036 0.68 NFE2L2 (0.48) XDHTXNRD1NFE2L2ALDH1A1HPGD
SCHEMBL12866088 0.68 MMP9 (0.59) XDHNFE2L2TDP1RELAAPP
SCHEMBL16704450 0.67 TRPA1 (0.62) XDHTXNRD1NFE2L2ALDH1A1HPGD
SCHEMBL12374357 0.66 TRPA1 (0.46) XDHALDH1A1HPGDTDP1TRIM24

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-8338700-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 US disclosed
US-8338701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 US disclosed
US-20110030801-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 US disclosed
US-20110031446-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 US disclosed