SCHEMBL5405495

SCHEMBL5405495

[SiH3]OCC(OC(c1ccccc1)c1ccccc1)N1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 7/20 0.46
CYP2C19 P33261 7/20 0.46
CYP3A4 P08684 7/20 0.46
CYP2D6 P10635 6/20 0.46
KCNH2 Q12809 5/20 0.46
CYP2C9 P11712 5/20 0.46
KCNA5 P22460 4/20 0.46
KCNE1 P15382 1/20 0.46
TSHR P16473 2/20 0.43
HIF1A Q16665 1/20 0.42
SLC22A1 O15245 1/20 0.42
CHRM2 P08172 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD1 P21728 1/20 0.42
TBXA2R P21731 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
ADRA1A P35348 1/20 0.42

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
SCHEMBL6186552 0.79 CYP1A2 (0.46) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
SCHEMBL8834093 0.76 CYP1A2 (0.50) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
SCHEMBL9818808 0.72 CYP2D6 (0.53) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
SCHEMBL6617339 0.67 CYP2D6 (0.42) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
SCHEMBL1802065 0.65 CYP3A4 (0.52) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
Perastine SCHEMBL1506306 0.65 CYP3A4 (0.83) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
SCHEMBL16227209 0.65 KCNA5 (1.00) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
SCHEMBL5267415 0.65 CYP2D6 (0.68) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
SCHEMBL16226493 0.65 KCNA5 (1.00) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2
SCHEMBL16227210 0.65 KCNA5 (1.00) CYP1A2CYP2C19CYP3A4CYP2D6KCNH2

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-7229729-B2 Electrophotographic photoreceptor, process cartridge, image forming apparatus and image forming method KONICA MONOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2007-06-12 US disclosed
US-20050037274-A1 Electrophotographic photoreceptor, process cartridge, image forming apparatus and image forming method KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2005-02-17 US disclosed
US-5622784-A WATERPROOFING; MODIFIED SILICON DIOXIDE THIN FILM SEIKO EPSON CORPORATION (JP) 1997-04-22 US disclosed