SCHEMBL12866244

SCHEMBL12866244

CCN(CC)c1ccc2c(c1)O/C(=C\c1ccc(O)cc1)N2CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.42
MAOA P21397 3/20 0.42
BACE1 P56817 4/20 0.37
ALDH1A1 P00352 6/20 0.37
KDM4E B2RXH2 3/20 0.37
GAA P10253 1/20 0.37
MEN1 O00255 3/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 3/20 0.36
CYP3A4 P08684 2/20 0.36
ESRRG P62508 2/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ALDH3A1 P30838 1/20 0.34
ALDH1A3 P47895 1/20 0.34

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
SCHEMBL12880702 0.84 MAOB (0.39) MAOBMAOABACE1ALDH1A1KDM4E
SCHEMBL13005254 0.83 MEN1 (0.39) MAOBMAOAALDH1A1KDM4EGAA
SCHEMBL13016923 0.79 KDM4E (0.33) MAOBMAOAALDH1A1KDM4EGAA
SCHEMBL12866302 0.75 EP300 (0.37) MAOBMAOABACE1ALDH1A1KDM4E
SCHEMBL12880708 0.69 MAOA (0.34) MAOBMAOAALDH1A1KDM4EGAA
SCHEMBL10957650 0.67 TLR7 (0.39) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL11330604 0.65 FGFR1 (0.43) BACE1ALDH1A1KDM4EGAAMEN1
SCHEMBL11330602 0.65 FGFR1 (0.43) BACE1ALDH1A1KDM4EGAAMEN1
SCHEMBL11330607 0.65 FGFR1 (0.43) BACE1ALDH1A1KDM4EGAAMEN1
SCHEMBL13264731 0.65 APP (0.62) MAOBBACE1ALDH1A1KDM4EGAA

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