SCHEMBL4776115

SCHEMBL4776115

CC(C)(CNC1CCCCC1)O[SiH3]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 4/20 0.38
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HTR1A P08908 1/20 0.35
CXCR4 P61073 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CXCL12 P48061 1/20 0.33
EPHX2 P34913 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
TSHR P16473 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
EPHX1 P07099 2/20 0.33

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
SCHEMBL6059264 0.82 RAD52 (0.39) ALDH1A1HSD17B10KDM4EMEN1KMT2A
SCHEMBL29843401 0.81 KDM4E (0.40) ALDH1A1HSD17B10KDM4EMEN1GAA
SCHEMBL1455086 0.78 KDM4E (0.34) ALDH1A1HSD17B10KDM4EMEN1GAA
SCHEMBL11053891 0.78 KDM4E (0.43) ALDH1A1HSD17B10KDM4EMEN1GAA
SCHEMBL18177820 0.78 KDM4E (0.43) ALDH1A1HSD17B10KDM4EMEN1GAA
SCHEMBL9285591 0.75 KDM4E (0.39) ALDH1A1HSD17B10KDM4EMEN1GAA
SCHEMBL94567 0.75 KDM4E (0.34) KDM4EMEN1GAAHTTKMT2A
SCHEMBL94568 0.75 ADH1B (0.38) KDM4ETDP1HTR1ACXCR4CXCL12
SCHEMBL11149818 0.74 KDM4E (0.40) ALDH1A1HSD17B10KDM4EMEN1GAA
SCHEMBL15114086 0.74 KDM4E (0.40) ALDH1A1HSD17B10KDM4EMEN1GAA

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
WO-2008015123-A1 PREPARATION OF ACID DERIVATIVE-FUNCTIONAL ORGANOSILICON COMPOUNDS WACKER CHEMIE AG (DE) 2008-02-07 WO disclosed
US-20060122413-A1 Aminomethylene functional siloxanes WACKER CHEMIE AG (DE) 2006-06-08 US disclosed
US-4404014-A MICROBIOCIDES FOR TEXTILES, LUMBER, AND PLASTICS; PESTICIDES DYNAMIT NOBEL AG (DE) 1983-09-13 US disclosed
US-4254270-A INSECTICIDES, BIOCIDES DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1981-03-03 US disclosed