SCHEMBL9857119

SCHEMBL9857119

CCOC(=O)CC(CC(/C=C/COC1CCCCO1)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 4/20 0.32
ADORA3 P0DMS8 1/20 0.32
SLC6A2 P23975 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SLC6A4 P31645 1/20 0.31
TSHR P16473 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
SCHEMBL9856810 0.81 TSHR (0.34) MEN1KMT2ATSHR
SCHEMBL9856975 0.81 ALDH1A1 (0.34) MEN1KMT2ATSHR
SCHEMBL9730290 0.78 TSHR (0.38) MEN1KMT2ATSHR
SCHEMBL9347640 0.73 TSHR (0.44) MEN1KMT2ATSHR
SCHEMBL10779090 0.72 TSHR (0.39) MEN1KMT2ATSHR
SCHEMBL12787299 0.71 TSHR (0.38) MEN1KMT2ATSHR
SCHEMBL23529640 0.71 TSHR (0.41) MEN1KMT2ATSHR
SCHEMBL2915808 0.71 TSHR (0.41) MEN1KMT2ATSHR
SCHEMBL29772371 0.71 TSHR (0.41) MEN1KMT2ATSHR
SCHEMBL2915807 0.71 TSHR (0.41) MEN1KMT2ATSHR

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
EP-0436851-A1 Compounds active as inhibitors of the enzyme HMG-CoA reductase and pharmaceutical compositions containing them ZAMBON GROUP S.p.A. (IT) 1991-07-17 EP disclosed