SCHEMBL9860909

SCHEMBL9860909

C=CC(C)O[Si](CCCNCc1ccccc1)(OCC)OCC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.41
CHRM2 P08172 1/20 0.40
SIGMAR1 Q99720 3/20 0.38
SCN8A Q9UQD0 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HDAC3 O15379 2/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC2 Q92769 2/20 0.36
HDAC8 Q9BY41 2/20 0.36
NCOR2 Q9Y618 2/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BCHE P06276 1/20 0.34

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
Ethylene SCHEMBL27935498 0.83 MAOA (0.51) MAOACHRM2SIGMAR1SCN8AMEN1
SCHEMBL136399 0.83 MAOA (0.55) MAOACHRM2SIGMAR1SCN8AMEN1
SCHEMBL4135709 0.81 CHRM2 (0.54) MAOACHRM2SIGMAR1SCN8AMEN1
SCHEMBL9761086 0.79 CHRM2 (0.62) MAOACHRM2SIGMAR1SCN8AMEN1
SCHEMBL29008123 0.79 MAOA (0.50) MAOACHRM2SIGMAR1SCN8AMEN1
SCHEMBL15360778 0.79 MAOA (0.58) MAOACHRM2SIGMAR1SCN8AMEN1
SCHEMBL20503705 0.77 CHRM2 (0.50) MAOACHRM2SIGMAR1SCN8AMEN1
SCHEMBL5810211 0.75 MEN1 (0.38) MAOACHRM2SIGMAR1SCN8AMEN1
SCHEMBL1519047 0.75 SIGMAR1 (0.35) SIGMAR1MEN1KMT2A
SCHEMBL15361183 0.74 MEN1 (0.53) MAOACHRM2SIGMAR1SCN8AMEN1

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
US-5059669-A Radiation curable polysiloxane having acrylated amino groups TORAY SILICONE COMPANY, LTD. (JP) 1991-10-22 US disclosed