SCHEMBL2467067

SCHEMBL2467067

CCCCOc1c(Cl)ccc(-c2cc(N)c(Cl)c(OC(=O)O)n2)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.37
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
CNR1 P21554 5/20 0.37
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
BCHE P06276 1/20 0.33
LIPE Q05469 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
MAPK9 P45984 3/20 0.32
MAPK8 P45983 2/20 0.32
MAPK1 P28482 2/20 0.32
PRKD2 Q9BZL6 2/20 0.32
PRKD3 O94806 1/20 0.32
MAPK10 P53779 1/20 0.32
XDH P47989 1/20 0.32
CYP3A4 P08684 1/20 0.32
KCNH2 Q12809 1/20 0.32
CACNA1C Q13936 1/20 0.32

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
SCHEMBL2463884 0.92 ALOX5AP (0.38) FFAR4ALOX5APFEN1HTTMAPK9
SCHEMBL2465145 0.90 CNR1 (0.37) FFAR4ALOX5APFEN1CNR1BCHE
SCHEMBL3454208 0.90 ALOX5AP (0.37) FFAR4ALOX5APFEN1MAPK9MAPK8
SCHEMBL2465298 0.88 ALOX5AP (0.37) FFAR4ALOX5APFEN1MAPK9MAPK8
SCHEMBL2467541 0.87 ALDH1A1 (0.37) FFAR4ALOX5APFEN1
SCHEMBL2465877 0.86 ALOX5AP (0.39) FFAR4ALOX5APFEN1
SCHEMBL2467065 0.85 ALOX5AP (0.38) FFAR4ALOX5APFEN1CNR1THRA
SCHEMBL17797202 0.85 RORC (0.35) FFAR4CNR1BCHELIPEHTT
SCHEMBL2465186 0.84 MAP4K1 (0.32) FFAR4ALOX5APFEN1MAPK9MAPK8
SCHEMBL17797209 0.83 MAPK9 (0.37) FFAR4THRBMAPK9MAPK8MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2060566-B1 Poly-substituted aryls DOW AGROSCIENCES LLC (US) 2016-06-08 EP claimed
EP-2939541-A1 HERBICIDE SAFENER COMBINATION Bayer Intellectual Property GmbH (DE) 2015-11-04 EP disclosed
EP-2939540-A1 HERBICIDE SAFENER COMBINATION Bayer Intellectual Property GmbH (DE) 2015-11-04 EP disclosed
EP-2369929-A2 HERBICIDE-SAFENER COMBINATION Bayer CropScience AG (DE) 2011-10-05 EP disclosed
WO-2010060581-A2 HERBICIDE-SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 WO disclosed
EP-2191719-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP disclosed