SCHEMBL28065552

SCHEMBL28065552

CCCCCOC(CN)[Si](OCC)(OCC)OCC

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.48
HTT P42858 1/20 0.37
LPAR1 Q92633 4/20 0.32
LPAR3 Q9UBY5 4/20 0.32
LPAR2 Q9HBW0 1/20 0.32
TLR2 O60603 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
OPRM1 P35372 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL28065599 0.83 DNM1 (0.50) DNM1HTTLPAR1LPAR3LPAR2
SCHEMBL28065674 0.79 DNM1 (0.34) DNM1LPAR1LPAR3LPAR2
SCHEMBL27975511 0.79 DNM1 (0.31) DNM1
SCHEMBL28828248 0.77 DNM1 (0.33) DNM1
SCHEMBL4651160 0.76 CYP3A4 (0.33)
SCHEMBL28273313 0.71 OPRM1 (0.38) DNM1OPRM1
SCHEMBL28027262 0.70
SCHEMBL15106253 0.69 OPRM1 (0.37) DNM1OPRM1
SCHEMBL10780852 0.69 DNM1 (0.61) DNM1HTTCA1CA2CA9
SCHEMBL21440326 0.68 DNM1 (0.32) DNM1OPRM1

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
CN-105566373-A Novel bisalkoxysilane compound and its production method SHINETSU CHEMICAL CO 2016-05-11 CN disclosed