SCHEMBL13809396

SCHEMBL13809396

FC(F)(F)Oc1ccc(Oc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.52
P2RY1 P47900 1/20 0.50
KIF11 P52732 2/20 0.49
NR3C1 P04150 1/20 0.47
PGR P06401 1/20 0.47
AR P10275 1/20 0.47
ESR2 Q92731 1/20 0.47
TLR8 Q9NR97 1/20 0.46
TLR7 Q9NYK1 1/20 0.46
MAPT P10636 1/20 0.46
TTBK1 Q5TCY1 2/20 0.45
TEAD1 P28347 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
SCN9A Q15858 1/20 0.44
MAPK14 Q16539 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL27579381 0.91 LTA4H (0.59) LTA4HKIF11NR3C1PGRAR
SCHEMBL11527555 0.87 KIF11 (0.51) P2RY1KIF11MAPTL3MBTL1CETP
SCHEMBL9798371 0.87 LTA4H (0.54) LTA4HKIF11NR3C1PGRAR
SCHEMBL9546526 0.85 L3MBTL1 (0.55) LTA4HKIF11NR3C1PGRAR
SCHEMBL9589615 0.82 LTA4H (0.53) LTA4HKIF11NR3C1PGRAR
SCHEMBL15635197 0.82 PPARG (0.55) LTA4HP2RY1KIF11NR3C1PGR
SCHEMBL3553556 0.82 LTA4H (0.52) LTA4HKIF11NR3C1PGRAR
SCHEMBL4043144 0.82 LTA4H (0.53) LTA4HKIF11NR3C1PGRAR
SCHEMBL5542591 0.82 LTA4H (0.52) LTA4HKIF11NR3C1PGRAR
SCHEMBL476378 0.82 ALDH1A1 (0.66) LTA4HKIF11NR3C1PGRAR

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-2072498-A1 N-PHENYLOXAMIDIC ACID DERIVATIVE Institute of Medicinal Molecular Design, Inc. (JP) 2009-06-24 EP disclosed