SCHEMBL14943012

SCHEMBL14943012

CCCOc1ccc2cc(S(=O)(=O)NCP(=O)(O)Oc3ccc(C#N)c(C(F)(F)F)c3)sc2c1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.36
PLA2G7 Q13093 1/20 0.35
CA2 P00918 3/20 0.35

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
SCHEMBL14943014 0.96 AR (0.36) ARPLA2G7
SCHEMBL14943071 0.95 AR (0.36) ARPLA2G7
SCHEMBL14943013 0.94 AR (0.36) ARPLA2G7
SCHEMBL13031933 0.89 CA2 (0.33) ARPLA2G7CA2
SCHEMBL13031927 0.87 CA2 (0.32) ARPLA2G7CA2
SCHEMBL13031939 0.87 CA2 (0.31) ARPLA2G7CA2
SCHEMBL13072844 0.87 CA2 (0.31) ARPLA2G7CA2
SCHEMBL16684143 0.86 PLA2G7 (0.32) ARPLA2G7
SCHEMBL13032081 0.86 TRPV4 (0.36) ARPLA2G7
SCHEMBL14943084 0.86 AR (0.35) ARPLA2G7

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-8440643-B2 Inhibitors of beta-lactamase METHYLGENE INC. (CA) 2013-05-14 US disclosed