SCHEMBL12866270

SCHEMBL12866270

CN(C)c1ccc2c(c1)OC=C/C2=C\C=C\c1ccc(O)c(OC=O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.40
MMP9 P14780 1/20 0.39
BACE1 P56817 3/20 0.36
APP P05067 2/20 0.36
DNMT1 P26358 1/20 0.36
TXNRD1 Q16881 1/20 0.35
MAPT P10636 2/20 0.33
SNCA P37840 1/20 0.33
ABCB1 P08183 1/20 0.32
FGFR1 P11362 1/20 0.32
METAP1 P53582 1/20 0.32
NQO2 P16083 1/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31

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
SCHEMBL12866297 0.85 XDH (0.40) XDHAPPMAPTSNCAMETAP1
SCHEMBL12881135 0.82 PTPN1 (0.43) MMP9APPMAPTSNCAMEN1
SCHEMBL12866088 0.74 MMP9 (0.59) XDHMMP9BACE1APPMAPT
SCHEMBL12866262 0.69 MMP9 (0.36) MMP9BACE1APPMAPTMEN1
SCHEMBL12866229 0.69 XDH (0.43) XDHAPPDNMT1TXNRD1MAPT
SCHEMBL24716532 0.68 ALDH1A1 (0.33) APPMAOAMAOB
SCHEMBL12866263 0.66 XDH (0.47) XDHMMP9BACE1APPDNMT1
SCHEMBL12866075 0.65 CCR4 (0.40) MMP9BACE1APPMAPTMEN1
SCHEMBL12866083 0.62 MAPT (0.54) MMP9MAPTNQO2MEN1NPC1
SCHEMBL1012820 0.62 ALDH1A1 (0.67) XDHAPPMAPTSNCATDP1

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-8338701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 US disclosed
US-8338700-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