SCHEMBL12866225

SCHEMBL12866225

CCCCCN1/C(=C/C=C/c2ccc(O)c(OC=O)c2)C=Cc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 3/20 0.41
HTR1A P08908 1/20 0.37
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
BLM P54132 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
XDH P47989 1/20 0.35
ALOX5 P09917 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DNMT1 P26358 1/20 0.34
APP P05067 3/20 0.33
TXNRD1 Q16881 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32

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
SCHEMBL12866260 0.86 APP (0.43) MEN1KMT2AMAPTALDH1A1HTR1A
SCHEMBL12976264 0.83 PTPN1 (0.43) MEN1KMT2AMAPTALDH1A1THRB
SCHEMBL12866232 0.73 PRMT1 (0.51) MAPTBLMAPP
SCHEMBL12866229 0.70 XDH (0.43) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL12866097 0.69 PSEN1 (0.50)
SCHEMBL10613637 0.66 PTGS1 (0.53) MEN1KMT2AMAPTALDH1A1HTR1A
SCHEMBL5323524 0.65 CES1 (0.53) MEN1KMT2AMAPTALDH1A1HTR1A
SCHEMBL12866251 0.64 PRMT1 (0.42) MEN1KMT2AMAPTALDH1A1XDH
SCHEMBL10449116 0.63 CES1 (0.48) MEN1KMT2AMAPTALDH1A1HTR1A
SCHEMBL10004420 0.63 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1HTR1A

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