SCHEMBL12866230

SCHEMBL12866230

Cc1ccc2c(c1)C(C)(C)/C(=C\C1=C(Cl)/C(=C/c3ccc(O)cc3)CCC1)N2CCOCCO

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
MIF P14174 1/20 0.31
EGFR P00533 1/20 0.31
CYP2C9 P11712 1/20 0.30
F3 P13726 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL12866275 0.92 EGFR (0.33) APPKDM4EMEN1MAPTHTT
SCHEMBL13005245 0.88 APP (0.33) APPKDM4EMEN1MAPTHTT
SCHEMBL12881946 0.85 EGFR (0.33) APPEGFR
SCHEMBL12866277 0.69 EGFR (0.40) APPMEN1MAPTKMT2AMIF
SCHEMBL13005252 0.66 APP (0.33) APPKDM4EMEN1MAPTKMT2A
SCHEMBL12866249 0.65 MEN1 (0.36) KDM4EMEN1MAPTHTTKMT2A
SCHEMBL18823460 0.61 APP (0.45) APPKDM4EMEN1MAPTHTT
SCHEMBL859682 0.60 PRMT1 (0.43) APPMEN1MAPTHTTKMT2A
SCHEMBL12866278 0.60 PTGDR2 (0.42) KDM4EMEN1MAPTHTTKMT2A
SCHEMBL12155008 0.59 MEN1 (0.45) APPMEN1MAPTHTTKMT2A

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