SCHEMBL6433895

SCHEMBL6433895

CC(C)(C)[Si](C)(C)Oc1ccc(C2CCC(CS(N)(=O)=O)CC2)c(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.36
CA1 P00915 4/20 0.36
CA9 Q16790 4/20 0.36
PREP P48147 2/20 0.34
DGAT1 O75907 1/20 0.33
CNR2 P34972 4/20 0.31
CASP3 P42574 1/20 0.30
CASP7 P55210 1/20 0.30
CNR1 P21554 1/20 0.30
STS P08842 1/20 0.30
RORC P51449 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
SCHEMBL6433716 0.82 CA12 (0.36) CA12CA1CA9PREPCNR2
SCHEMBL6433400 0.82 CA12 (0.36) CA12CA1CA9PREPCNR2
SCHEMBL6433023 0.82 CA12 (0.36) CA12CA1CA9PREPCNR2
SCHEMBL5360774 0.80 CA12 (0.39) CA12CA1CA9PREPCNR2
SCHEMBL6433948 0.80 CA12 (0.39) CA12CA1CA9PREPCNR2
SCHEMBL5360778 0.80 CA12 (0.39) CA12CA1CA9PREPCNR2
SCHEMBL6433944 0.80 CA12 (0.39) CA12CA1CA9PREPCNR2
SCHEMBL6499011 0.80 CA12 (0.39) CA12CA1CA9PREPCNR2
SCHEMBL5363897 0.80 CA12 (0.39) CA12CA1CA9PREPCNR2
SCHEMBL6434515 0.80 CA12 (0.39) CA12CA1CA9PREPCNR2

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