SCHEMBL8111972

SCHEMBL8111972

[NH]C(=O)c1ccc(-c2cccc(Oc3csc(C(F)(F)F)c3)n2)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B14 Q9BPX1 2/20 0.38
SCN9A Q15858 2/20 0.37
MAPT P10636 2/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
MPL P40238 2/20 0.35
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
NTRK1 P04629 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
F10 P00742 2/20 0.31
CTSA P10619 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31

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
SCHEMBL8120723 0.76 SCN9A (0.36) SCN9AMAPTKDM4EMEN1ALDH1A1
SCHEMBL5548596 0.73 CHRM5 (0.38) SCN9AMAPTF10
SCHEMBL8092122 0.72 MAPT (0.35) SCN9AMAPTKDM4EL3MBTL1F10
SCHEMBL8126138 0.72 MAPT (0.35) MAPTF10
SCHEMBL8126331 0.72 KDM4E (0.46) MAPTKDM4EHPGDL3MBTL1MEN1
SCHEMBL8125995 0.72 MAPT (0.35) SCN9AMAPTF10
SCHEMBL8127308 0.71 MAPT (0.34) SCN9AMAPTF10
SCHEMBL8126096 0.71 MAPT (0.34) MAPTF10
SCHEMBL8121468 0.70 MAPT (0.52) MAPTKDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL8125113 0.70 MAPT (0.34) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1028959-A1 HERBICIDAL FURANYL- AND THIENYLOXYAZINES AMERICAN CYANAMID COMPANY (US) 2000-08-23 EP claimed
WO-1999024427-A1 HERBICIDAL FURANYL- AND THIENYLOXYAZINES AMERICAN CYANAMID COMPANY (US) 1999-05-20 WO claimed
EP-1028959-A1 HERBICIDAL FURANYL- AND THIENYLOXYAZINES AMERICAN CYANAMID COMPANY (US) 2000-08-23 EP disclosed
WO-1999024427-A1 HERBICIDAL FURANYL- AND THIENYLOXYAZINES AMERICAN CYANAMID COMPANY (US) 1999-05-20 WO disclosed