SCHEMBL6433055

SCHEMBL6433055

CC(C)(C)[Si](C)(C)Oc1ccc([C@H]2CC[C@@](C)(O)CC2)c(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.37
CA1 P00915 4/20 0.37
CA9 Q16790 4/20 0.37
ESR2 Q92731 1/20 0.37
PREP P48147 4/20 0.33
PDE10A Q9Y233 3/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
HSD11B1 P28845 1/20 0.32
TGFBR1 P36897 1/20 0.32
HPGDS O60760 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
SCHEMBL6433061 1.00 CA12 (0.37) CA12CA1CA9ESR2PREP
SCHEMBL6499014 0.91 CA12 (0.38) CA12CA1CA9PREPHSP90AA1
SCHEMBL6434920 0.85 CA12 (0.37) CA12CA1CA9PREPHSP90AA1
SCHEMBL6434515 0.84 CA12 (0.39) CA12CA1CA9PREPHSP90AA1
SCHEMBL6433944 0.84 CA12 (0.39) CA12CA1CA9PREPHSP90AA1
SCHEMBL6433948 0.84 CA12 (0.39) CA12CA1CA9PREPHSP90AA1
SCHEMBL6499011 0.84 CA12 (0.39) CA12CA1CA9PREPHSP90AA1
SCHEMBL6804163 0.82 CA12 (0.40) CA12CA1CA9PREPHSP90AA1
SCHEMBL5360778 0.81 CA12 (0.39) CA12CA1CA9PREPHSP90AA1
SCHEMBL5360774 0.81 CA12 (0.39) CA12CA1CA9PREPHSP90AA1

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-1165495-B1 RESORCINOL DERIVATIVES PFIZER (US) 2005-04-20 EP disclosed