SCHEMBL14845201

SCHEMBL14845201

CC(C)(C)OC(=O)NC1CON(CC(F)(F)F)C1=O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SCN9A Q15858 7/20 0.37
CTSK P43235 2/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BTK Q06187 1/20 0.35
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
PRSS1 P07477 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
SCHEMBL14844368 1.00 GAA (0.48) GAANFKB1NFKB2RELASCN9A
SCHEMBL2010969 0.85 GAA (0.51) GAANFKB1NFKB2RELACTSK
SCHEMBL2010967 0.85 GAA (0.51) GAANFKB1NFKB2RELACTSK
SCHEMBL2015566 0.84 GAA (0.47) GAANFKB1NFKB2RELASCN9A
SCHEMBL12274513 0.84 GAA (0.47) GAANFKB1NFKB2RELASCN9A
SCHEMBL2011320 0.83 GAA (0.49) GAANFKB1NFKB2RELACTSK
SCHEMBL2011317 0.83 GAA (0.49) GAANFKB1NFKB2RELACTSK
SCHEMBL9908799 0.81 GAA (0.47) GAANFKB1NFKB2RELACTSK
SCHEMBL4760849 0.81 GAA (0.47) GAANFKB1NFKB2RELACTSK
SCHEMBL23571245 0.80 CYP11B1 (0.32)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763970-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2014-08-13 EP disclosed
WO-2013050302-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-04-11 WO disclosed