SCHEMBL13586325

SCHEMBL13586325

C/C=C/c1ccc(-c2ccc(OCc3ccc(-c4ccc(C5CO5)c(F)c4F)cc3)c(F)c2F)cc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 1/20 0.34
▸ ALOX5AP P20292 2/20 0.31
▸ FEN1 P39748 2/20 0.31
▸ KCNA3 P22001 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
SCHEMBL12822373 1.00 FFAR4 (0.34) FFAR4ALOX5APFEN1KCNA3
SCHEMBL12907755 0.91 ALDH1A1 (0.35) FFAR4KCNA3
SCHEMBL10303282 0.91 FFAR4 (0.33) FFAR4ALOX5APFEN1
SCHEMBL12822782 0.88 ALOX5AP (0.32) FFAR4ALOX5APFEN1
SCHEMBL12823291 0.88 ALOX5AP (0.32) FFAR4ALOX5APFEN1
SCHEMBL13586128 0.86 FFAR4 (0.34) FFAR4FEN1KCNA3
SCHEMBL13586221 0.86 FFAR4 (0.38) FFAR4ALOX5APFEN1
SCHEMBL12821314 0.86 FFAR4 (0.38) FFAR4ALOX5APFEN1
SCHEMBL12908112 0.86 MRGPRX4 (0.40) FFAR4ALOX5APFEN1
SCHEMBL12822902 0.86 FEN1 (0.35) FFAR4ALOX5APFEN1

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
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — WO disclosed
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