SCHEMBL14766940

SCHEMBL14766940

CCCCOC1CCC(c2ccc(C3CCC(OCc4ccc(OCC)cc4F)CC3)c(F)c2F)CC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.37
CRBN Q96SW2 1/20 0.34
PPARD Q03181 1/20 0.33
HTR1A P08908 1/20 0.33
CNR2 P34972 6/20 0.33
CNR1 P21554 3/20 0.33
HTR2A P28223 2/20 0.33
SCN9A Q15858 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
HTR6 P50406 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
FFAR1 O14842 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 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
SCHEMBL14766406 0.97 CRBN (0.37) NAAACRBNHTR1ACNR2CNR1
SCHEMBL14765918 0.94 CRBN (0.33) NAAACRBNPPARDHTR1ACNR2
SCHEMBL14766916 0.94 CRBN (0.36) NAAACRBNHTR1ACNR2CNR1
SCHEMBL14766817 0.91 NAAA (0.39) NAAAHTR1AHTR2AMAOAMAOB
SCHEMBL12740279 0.90 CRBN (0.36) NAAACRBNHTR1ACNR2CNR1
SCHEMBL14765908 0.90 CRBN (0.36) CRBNHTR1ACNR2CNR1HTR2A
SCHEMBL14767144 0.90 FFAR4 (0.39) NAAAPPARDFFAR1
SCHEMBL14766918 0.90 CRBN (0.33) NAAACRBNHTR1ACNR2CNR1
SCHEMBL14766606 0.90 FFAR4 (0.40) NAAACRBNPPARDHTR2AFFAR1
SCHEMBL12740276 0.90 NAAA (0.35) NAAACRBNHTR1ACNR2CNR1

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
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed