SCHEMBL7939506

SCHEMBL7939506

CC(C)(C)[Si](C)(C)OCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1.OCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 15/20 0.40
NMBR P28336 1/20 0.37
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
ENPP2 Q13822 1/20 0.31
BACE1 P56817 1/20 0.31

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
SCHEMBL1097103 0.94 SIRT2 (0.42) SIRT2NMBRCYP11B1CYP11B2ENPP2
SCHEMBL8543176 0.89 SIRT2 (0.40) SIRT2NMBRCYP11B1CYP11B2ENPP2
SCHEMBL1342 0.84 SIRT2 (0.45) SIRT2NMBRCYP11B1CYP11B2ENPP2
SCHEMBL6771514 0.83 SIRT2 (0.44) SIRT2NMBRCYP11B1CYP11B2ENPP2
SCHEMBL1037597 0.82 SIRT2 (0.45) SIRT2NMBRCYP11B1CYP11B2ENPP2
SCHEMBL7713289 0.81 SIRT2 (0.46) SIRT2NMBR
SCHEMBL1039638 0.81 SIRT2 (0.43) SIRT2NMBRCYP11B1CYP11B2
Acetic Acid SCHEMBL7659782 0.80 SIRT2 (0.47) SIRT2NMBRCYP11B1CYP11B2ENPP2
SCHEMBL1039740 0.80 SIRT2 (0.43) SIRT2NMBRCYP11B1CYP11B2
SCHEMBL9069663 0.79 SIRT2 (0.44) SIRT2

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
WO-2001017992-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-03-15 WO disclosed