SCHEMBL6658630

SCHEMBL6658630

C[SiH](OC(=O)CCCC(=O)O[SiH](C)c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
RECQL P46063 1/20 0.38
LMNA P02545 2/20 0.36
TSHR P16473 3/20 0.35
TDP1 Q9NUW8 3/20 0.35
AKT1 P31749 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 3/20 0.34
GAA P10253 1/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
HPGD P15428 1/20 0.34
ALOX5 P09917 1/20 0.33
HDAC3 O15379 1/20 0.33
MAPK1 P28482 1/20 0.33
ADRA1A P35348 1/20 0.33
HDAC4 P56524 1/20 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
SCHEMBL6658633 0.95 TSHR (0.44) LMNATSHRMAPTALDH1A1HDAC3
SCHEMBL6656373 0.92 ALDH1A1 (0.38) KMT2AKDM4EMEN1RECQLLMNA
SCHEMBL6555991 0.90 PRSS1 (0.36) KMT2AKDM4EMEN1RECQLLMNA
SCHEMBL7059552 0.89 CES2 (0.47) KMT2AKDM4EMEN1RECQLLMNA
SCHEMBL7054284 0.89 CES2 (0.47) KMT2AKDM4EMEN1RECQLLMNA
SCHEMBL7058952 0.87 CES2 (0.42) KMT2AKDM4EMEN1RECQLLMNA
SCHEMBL6656378 0.87 NR4A2 (0.41) KDM4ELMNATSHRL3MBTL1MAPT
SCHEMBL6555999 0.86 TDP1 (0.33) KMT2AKDM4EMEN1RECQLLMNA
SCHEMBL7056823 0.83 ELANE (0.42) KMT2AKDM4ERECQLLMNATSHR
SCHEMBL7056407 0.81 ALDH1A1 (0.39) KMT2AKDM4EMEN1LMNATSHR

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
WO-2004005302-A1 PROCESS FOR THE PREPARATION OF ACYLOXYSILANES SIGMA COATINGS B.V. (NL) 2004-01-15 WO disclosed