SCHEMBL12866275

SCHEMBL12866275

Cc1ccc2c(c1)C(C)(C)/C(=C\C1=C(Cl)/C(=C/c3ccc(O)c(O)c3)CCC1)N2CCOCCO

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.33
APP P05067 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 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
SCHEMBL12881946 0.93 EGFR (0.33) EGFRAPPMGAMGAASI
SCHEMBL12866230 0.92 APP (0.33) EGFRAPPKDM4EMEN1MAPT
SCHEMBL13005245 0.91 APP (0.33) APPGAAKDM4EMEN1MAPT
SCHEMBL12866277 0.77 EGFR (0.40) EGFRAPPMGAMGAASI
SCHEMBL15235471 0.73 GAA (0.38) EGFRMGAMGAASIMGAM2
SCHEMBL12866278 0.70 PTGDR2 (0.42) GAAKDM4EMEN1MAPTHTT
SCHEMBL13005252 0.69 APP (0.33) EGFRAPPKDM4EMEN1MAPT
SCHEMBL12866249 0.69 MEN1 (0.36) EGFRGAAKDM4EMEN1MAPT
SCHEMBL12866187 0.63 APP (0.44) APPGAAKDM4EMEN1MAPT
SCHEMBL15235539 0.63 EGFR (0.45) EGFRMGAMGAASIMGAM2

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 3 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-20110030801-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 US disclosed
US-7851701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-12-14 US disclosed