SCHEMBL5010158

SCHEMBL5010158

CCCCCCCCCCCCCCCCCCc1ccc2c(oc3ccc([Si](OCC)(OCC)OCC)cc32)c1CCCCCCCCCCCCCCCCCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.35
LTB4R Q15722 1/20 0.35
STS P08842 2/20 0.33
ALOX15 P16050 2/20 0.32
TYR P14679 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX5 P09917 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PTGS2 P35354 1/20 0.31
KDM4E B2RXH2 2/20 0.31
NOD2 Q9HC29 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 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
SCHEMBL5013814 0.76 ESR1 (0.40) SRCTYRMAPTPTGS2KDM4E
SCHEMBL3453786 0.76 ESR1 (0.40) SRCTYRMAPTPTGS2KDM4E
SCHEMBL5010801 0.75 SRC (0.42) SRCSTSALOX15TYRMEN1
SCHEMBL16981555 0.67 CYP1A2 (0.45) ALOX15TP53CYP3A4PTGS2KDM4E
SCHEMBL16981552 0.67 CYP1A2 (0.45) ALOX15TP53CYP3A4PTGS2KDM4E
SCHEMBL13564086 0.67 CYP1A2 (0.45) ALOX15TP53CYP3A4PTGS2KDM4E
SCHEMBL14092904 0.66 CNR1 (0.33) SRCLTB4RALOX5PTGS2KDM4E
SCHEMBL13564005 0.65 CYP1A2 (0.46) ALOX15TP53CYP3A4PTGS2KDM4E
SCHEMBL14340029 0.65 HSD17B10 (0.52) MEN1KMT2ATP53CYP3A4MAPT
SCHEMBL5483456 0.65 HSD17B10 (0.52) MEN1KMT2ATP53CYP3A4MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed