SCHEMBL28614693

SCHEMBL28614693

C=C(c1ccccc1)c1ccc([Si](CC)(OC)OC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GRM2 Q14416 2/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
GFER P55789 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
PDE4A P27815 2/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 2/20 0.32
ELANE P08246 2/20 0.32
LMNA P02545 1/20 0.32
ATM Q13315 1/20 0.32
ESR1 P03372 2/20 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
SCHEMBL28935450 0.86 MEN1 (0.37) MEN1KMT2AGRM2MAPTALDH1A1
SCHEMBL30132007 0.86 MEN1 (0.37) MEN1KMT2AGRM2MAPTALDH1A1
SCHEMBL28619621 0.85 MEN1 (0.42) MEN1KMT2AGRM2MAPTALDH1A1
SCHEMBL28624856 0.83 MEN1 (0.43) MEN1KMT2AGRM2MAPTALDH1A1
SCHEMBL31468476 0.83 KMT2A (0.41) MEN1KMT2AGRM2MAPTALDH1A1
SCHEMBL31468617 0.83 MEN1 (0.47) MEN1KMT2AGRM2MAPTALDH1A1
SCHEMBL28620078 0.83 MEN1 (0.40) MEN1KMT2AGRM2MAPTALDH1A1
SCHEMBL296205 0.80 CA4 (0.35) ALDH1A1HTTESR1ESR2
SCHEMBL31468644 0.79 MEN1 (0.38) MEN1KMT2AGRM2
SCHEMBL31468568 0.79 KMT2A (0.38) MEN1KMT2AMAPTALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113354777-A Preparation method of multifunctional SIBR (silicon-oxygen-nitrogen-containing) integrated rubber with adjustable silicon-oxygen/nitrogen group sequence by one-step feeding control 大连理工大学 2021-09-07 CN claimed
CN-113307912-A Silica functionalized SIBR (silicon-oxygen-functionalized-polymer-based elastomer) integrated rubber with star-shaped coupling structure and preparation method thereof 大连理工大学 2021-08-27 CN claimed
CN-113354777-B Preparation method of multifunctional SIBR (silicon-oxygen-nitrogen-containing) integrated rubber with adjustable silicon-oxygen/nitrogen group sequence by one-step feeding control 大连理工大学(CN) 2023-01-13 CN disclosed
CN-113354777-A Preparation method of multifunctional SIBR (silicon-oxygen-nitrogen-containing) integrated rubber with adjustable silicon-oxygen/nitrogen group sequence by one-step feeding control 大连理工大学 2021-09-07 CN disclosed
CN-113307912-A Silica functionalized SIBR (silicon-oxygen-functionalized-polymer-based elastomer) integrated rubber with star-shaped coupling structure and preparation method thereof 大连理工大学 2021-08-27 CN disclosed