SCHEMBL12717309

SCHEMBL12717309

CCCC(O)c1ccc(-c2ccc(OCc3ccc(-c4ccc(C5CO5)c(F)c4F)cc3)c(F)c2F)cc1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 2/20 0.34
▸ PDE4B Q07343 2/20 0.34
▸ PDE4C Q08493 2/20 0.34
▸ PDE4D Q08499 2/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.32
▸ ALOX5AP P20292 2/20 0.31
▸ FEN1 P39748 2/20 0.31
▸ FPR2 P25090 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
SCHEMBL13586363 1.00 PDE4A (0.34) PDE4APDE4BPDE4CPDE4DFFAR4
SCHEMBL12822790 0.92 PDE4A (0.33) PDE4APDE4BPDE4CPDE4DFFAR4
SCHEMBL13654000 0.92 PDE4D (0.36) PDE4APDE4BPDE4CPDE4DFFAR4
SCHEMBL12907051 0.91 FPR2 (0.32) FFAR4ALOX5APFEN1FPR2
SCHEMBL12823858 0.88 FFAR4 (0.34) FFAR4ALOX5APFEN1FPR2
SCHEMBL12821318 0.88 FFAR4 (0.34) FFAR4ALOX5APFEN1FPR2
SCHEMBL12821187 0.87 PDE4A (0.34) PDE4APDE4BPDE4CPDE4DFFAR4
SCHEMBL12821312 0.86 KMT2A (0.37) FFAR4
SCHEMBL12822822 0.86 KMT2A (0.37) FFAR4
SCHEMBL12822535 0.85 S1PR5 (0.35) PDE4APDE4BPDE4CPDE4DFFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2305627-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2011-04-06 — — EP disclosed
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
Send feedback