SCHEMBL5389404

SCHEMBL5389404

CC(=O)O[Si](C)(OC(C)=O)C(Oc1ccccc1)(Oc1ccccc1)OP(O)O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.34
MTNR1B P49286 5/20 0.34
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33
HSP90AA1 P07900 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ELANE P08246 1/20 0.32
PPARG P37231 1/20 0.30
TP53 P04637 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
THRB P10828 1/20 0.30
GFER P55789 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL5389446 0.88 MTNR1A (0.34) MTNR1AMTNR1BALDH1A1MAPTHSP90AA1
SCHEMBL5387976 0.81 CA4 (0.33)
SCHEMBL5387465 0.74
SCHEMBL5391936 0.73 CA4 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL5398973 0.70 ALDH1A1 (0.30) ALDH1A1
SCHEMBL5388550 0.70 LTA4H (0.33) MAPT
SCHEMBL25263655 0.66 MTNR1A (0.44) MTNR1AMTNR1BALDH1A1MAPTHSP90AA1
SCHEMBL27648804 0.64 ALOX15 (0.43) MTNR1AMTNR1BALDH1A1MAPTHSP90AA1
SCHEMBL5406720 0.64
SCHEMBL784043 0.63 ELANE (0.41) MTNR1AMTNR1BALDH1A1MAPTHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276615-B2 Organofunctional surface-modified metal oxides WACKER CHEMIE AG (DE) 2007-10-02 US disclosed
US-20040220419-A1 Organofunctional surface-modified metal oxides WACKER-CHEMIE GMBH (DE) 2004-11-04 US disclosed