SCHEMBL2012369

SCHEMBL2012369

FC(F)(F)C=Cc1cccc(OC(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.47
PIM2 Q9P1W9 1/20 0.47
NFE2L2 Q16236 4/20 0.44
CHEK1 O14757 1/20 0.43
RELA Q04206 1/20 0.40
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
GPR3 P46089 1/20 0.37
CYP19A1 P11511 1/20 0.37
NQO2 P16083 1/20 0.37

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
SCHEMBL13790335 0.85 RELA (0.55) PIM1PIM2NFE2L2CHEK1RELA
SCHEMBL20283189 0.84 NFE2L2 (0.50) PIM1PIM2NFE2L2CHEK1RELA
SCHEMBL13841249 0.82 PIM1 (0.47) PIM1PIM2NFE2L2CHEK1RELA
SCHEMBL1045095 0.82 PIM1 (0.47) PIM1PIM2NFE2L2CHEK1RELA
SCHEMBL1045096 0.82 PIM1 (0.47) PIM1PIM2NFE2L2CHEK1RELA
SCHEMBL13562810 0.82 PIM1 (0.47) PIM1PIM2NFE2L2CHEK1RELA
SCHEMBL4293317 0.81 PIM1 (0.49) PIM1PIM2CHEK1CHRM2CHRM1
SCHEMBL31381747 0.81 PIM1 (0.49) PIM1PIM2CHEK1CHRM2CHRM1
SCHEMBL21287982 0.79 PIM1 (0.50) PIM1PIM2CHEK1CHRM2CHRM1
SCHEMBL12760707 0.79 CYP19A1 (0.55) PIM1PIM2NFE2L2CHEK1RELA

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-2507230-A1 INSECTICIDAL COMPOUNDS BASED ON ISOXAZOLINE DERIVATIVES Syngenta Participations AG (CH) 2012-10-10 EP disclosed
WO-2011067272-A1 INSECTICIDAL COMPOUNDS BASED ON ISOXAZOLINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2011-06-09 WO disclosed