SCHEMBL28009482

SCHEMBL28009482

FC(F)(F)CNc1ccc(Cl)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ATM Q13315 1/20 0.49
NPC1 O15118 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
RAB9A P51151 2/20 0.45
HSP90AA1 P07900 1/20 0.45
NPY1R P25929 1/20 0.45
NPY2R P49146 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
EPHX1 P07099 2/20 0.42
EPHX2 P34913 2/20 0.42
AR P10275 3/20 0.42
CYP3A4 P08684 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SLC2A1 P11166 1/20 0.40

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
SCHEMBL9189930 0.83 IL1B (0.43) MAPTMEN1KMT2ANPC1NPSR1
SCHEMBL453843 0.83 IL1B (0.43) MAPTMEN1KMT2AL3MBTL1ATM
SCHEMBL18300960 0.83 RAPGEF4 (0.40) MAPTMEN1KMT2AL3MBTL1ATM
SCHEMBL28115527 0.80 AR (0.38) MAPTMEN1KMT2AL3MBTL1ATM
SCHEMBL28009497 0.79 IL1B (0.36) MAPTMEN1KMT2ANPC1NPSR1
SCHEMBL3290963 0.79 SLC22A12 (0.47) MAPTARIDO1
SCHEMBL10426372 0.77 SMN1; SMN2 (0.44) MEN1KMT2ANPC1LMNARAB9A
SCHEMBL11651664 0.76 MEN1 (0.52) MAPTMEN1KMT2AL3MBTL1ATM
SCHEMBL10888882 0.75 MEN1 (0.51) MAPTMEN1KMT2AL3MBTL1ATM
SCHEMBL18585308 0.74 KMT2A (0.45) MAPTMEN1KMT2ANPC1LMNA

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
CN-104642338-A Methods of pest control in soybean SYNGENTA PARTICIPATIONS AG 2015-05-27 CN disclosed