SCHEMBL12866229

SCHEMBL12866229

CN1C=C/C(=C\C=C\c2ccc(O)c(OC=O)c2)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.43
DNMT1 P26358 1/20 0.38
TXNRD1 Q16881 1/20 0.36
MAOA P21397 3/20 0.36
MAOB P27338 3/20 0.36
MAPT P10636 5/20 0.34
ALDH1A1 P00352 4/20 0.34
KMT2A Q03164 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
APP P05067 2/20 0.34
SNCA P37840 1/20 0.34
MEN1 O00255 2/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL12866258 0.84 XDH (0.43) XDHMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL12880693 0.81 PTPN1 (0.49) MAOAMAOBAPPPTGS2MCL1
SCHEMBL12976267 0.78 MAPT (0.32) XDHDNMT1MAOAMAOBMAPT
SCHEMBL12866225 0.70 MEN1 (0.41) XDHDNMT1TXNRD1MAOAMAOB
SCHEMBL10625415 0.70 MAPT (0.46) MAPTALDH1A1KMT2AL3MBTL1APP
SCHEMBL10625407 0.70 MAPT (0.46) MAPTALDH1A1KMT2AL3MBTL1APP
SCHEMBL12866270 0.69 XDH (0.40) XDHDNMT1TXNRD1MAOAMAOB
SCHEMBL12866255 0.67 MAPT (0.55) MAPTALDH1A1KMT2AL3MBTL1APP
SCHEMBL12866263 0.66 XDH (0.47) XDHDNMT1TXNRD1MAOAMAOB
SCHEMBL12866036 0.64 NFE2L2 (0.48) XDHTXNRD1MAOAMAOBMAPT

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