SCHEMBL14943014

SCHEMBL14943014

CCCCCOc1ccc2cc(S(=O)(=O)NCP(=O)(O)Oc3ccc(C#N)c(C(F)(F)F)c3)sc2c1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.36
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
PLA2G7 Q13093 1/20 0.34

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
SCHEMBL14943071 0.99 AR (0.36) ARTHRATHRBPLA2G7
SCHEMBL14943012 0.96 AR (0.36) ARPLA2G7
SCHEMBL14943013 0.90 AR (0.36) ARPLA2G7
SCHEMBL13031927 0.88 CA2 (0.32) ARPLA2G7
SCHEMBL13031939 0.88 CA2 (0.31) ARPLA2G7
SCHEMBL13072844 0.88 CA2 (0.31) ARPLA2G7
SCHEMBL13031933 0.87 CA2 (0.33) ARPLA2G7
SCHEMBL16684143 0.84 PLA2G7 (0.32) ARPLA2G7
SCHEMBL13032081 0.84 TRPV4 (0.36) ARPLA2G7
SCHEMBL14943082 0.83 SLC22A12 (0.34) 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