SCHEMBL2895206

SCHEMBL2895206

FC(F)(F)c1[c]cnn1-c1c(Cl)cccc1Br

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.35
ENPP1 P22413 1/20 0.35
CHRM5 P08912 1/20 0.31
CHRM3 P20309 1/20 0.31
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2897719 0.90 CHRM5 (0.34) CHRM5CHRM3ALDH1A1SMN1; SMN2
SCHEMBL2897523 0.90 ENPP3 (0.33) ENPP3ENPP1
SCHEMBL2897658 0.77 HSD11B1 (0.31)
SCHEMBL2901157 0.76 RXRA (0.35)
SCHEMBL15015880 0.74 HTR3E (0.36) ALDH1A1
SCHEMBL2893944 0.72 TRPA1 (0.41)
SCHEMBL2897661 0.72 EPHX2 (0.35) ALDH1A1
SCHEMBL2901667 0.72 MAPK14 (0.30)
SCHEMBL2903122 0.70
SCHEMBL885439 0.69 PTGS1 (0.43) SMN1; SMN2

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-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP disclosed