SCHEMBL4599486

SCHEMBL4599486

CCO[Si](CCCNC(=O)OCOCCOCCOC)(OCC)OCC

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.41
EPHX1 P07099 1/20 0.34
ABCB11 O95342 1/20 0.34
CYP3A4 P08684 1/20 0.34
ADRA2B P18089 1/20 0.34
OPRD1 P41143 1/20 0.34
SCN5A Q14524 1/20 0.34
TSHR P16473 1/20 0.33

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
SCHEMBL13711776 0.92 ACHE (0.50) ACHEEPHX1ABCB11CYP3A4ADRA2B
SCHEMBL28527084 0.92 ACHE (0.50) ACHEEPHX1ABCB11CYP3A4ADRA2B
SCHEMBL1006958 0.92 ACHE (0.50) ACHEEPHX1ABCB11CYP3A4ADRA2B
SCHEMBL436399 0.92 ACHE (0.50) ACHEEPHX1ABCB11CYP3A4ADRA2B
SCHEMBL28371240 0.89 ACHE (0.49) ACHE
SCHEMBL13484062 0.87 ACHE (0.54) ACHEEPHX1TSHR
SCHEMBL2616673 0.83 ACHE (0.53) ACHETSHR
SCHEMBL28349559 0.83 ACHE (0.53) ACHETSHR
SCHEMBL25768077 0.83 ACHE (0.53) ACHEEPHX1
SCHEMBL16986426 0.82 EPHX2 (0.40) EPHX1TSHR

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-20080127856-A1 Paste wax composition ENERGIZER GROUP LIMITED (GB) 2008-06-05 US claimed