SCHEMBL8760736

SCHEMBL8760736

C=Cc1ccc(C=NCCNCCC[Si](OC)(OC)OC)cc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL8760826 0.87 ALDH1A1 (0.40) ALDH1A1KDM4EKMT2ACA12CA1
SCHEMBL8760864 0.86 CA2 (0.38) CA12CA1CA2CA9
SCHEMBL9063827 0.80 MAPT (0.40) ALDH1A1MAPT
SCHEMBL768161 0.80 CHRM2 (0.48) ALDH1A1KDM4E
SCHEMBL5684928 0.79 ALDH1A1 (0.44) ALDH1A1KDM4EKMT2ACA12CA1
SCHEMBL20960343 0.79 ALDH1A1 (0.44) ALDH1A1KDM4EKMT2ACA12CA1
SCHEMBL5684934 0.79 ALDH1A1 (0.44) ALDH1A1KDM4EKMT2ACA12CA1
SCHEMBL2439572 0.79 CHRM2 (0.46) ALDH1A1KDM4EMAPT
Hydrochloric Acid SCHEMBL9064277 0.78 MAPT (0.39) ALDH1A1MAPT
Hydrochloric Acid SCHEMBL687642 0.78 CHRM2 (0.47) KDM4EL3MBTL1

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-5698725-A IMINE-CONTAINING ORGANOSILICON COMPOUND DOW CORNING TORAY SILICONE CO., LTD. (JP) 1997-12-16 US disclosed
EP-0768313-A2 A surface treating agent for glass fiber substrates Dow Corning Toray Silicone Company Limited (JP) 1997-04-16 EP disclosed