SCHEMBL7858801

SCHEMBL7858801

CCCC1COC(CCc2cc(F)c(-c3ccc(OC(F)(F)F)c(F)c3)c(F)c2)OC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 8/20 0.35
HCRTR1 O43613 5/20 0.34
HCRTR2 O43614 5/20 0.34
CTSK P43235 1/20 0.33
NAAA Q02083 1/20 0.33
P2RX7 Q99572 2/20 0.33

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
SCHEMBL7858889 0.84 GRM2 (0.36) GRM2HCRTR1HCRTR2CTSKNAAA
SCHEMBL7779267 0.84 P2RX7 (0.35) HCRTR1HCRTR2P2RX7
SCHEMBL7779268 0.84 P2RX7 (0.35) HCRTR1HCRTR2P2RX7
SCHEMBL17407521 0.79 GRM2 (0.33) GRM2CTSKNAAA
SCHEMBL7781455 0.78 P2RX7 (0.34) HCRTR1HCRTR2P2RX7
SCHEMBL9013302 0.78 HCRTR1 (0.33) GRM2HCRTR1HCRTR2CTSKNAAA
SCHEMBL9013298 0.78 HCRTR1 (0.33) GRM2HCRTR1HCRTR2CTSKNAAA
SCHEMBL7781460 0.78 P2RX7 (0.34) HCRTR1HCRTR2P2RX7
SCHEMBL7782296 0.77 PDE2A (0.34) GRM2HCRTR1HCRTR2P2RX7
SCHEMBL7782301 0.77 PDE2A (0.34) GRM2HCRTR1HCRTR2P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0881221-B1 DIOXANE DERIVATIVES, LIQUID-CRYSTAL COMPOSITIONS CONTAINING THE SAME, AND LIQUID-CRYSTAL DISPLAY DEVICES MADE BY USING THE SAME JNC CORP (JP) 2016-06-29 EP disclosed
US-6235355-B1 OPTICAL APPARATUS WITH LIQUID CRYSTALS CHISSO CORPORATION (JP) 2001-05-22 US disclosed
EP-0881221-A1 DIOXANE DERIVATIVES, LIQUID-CRYSTAL COMPOSITIONS CONTAINING THE SAME, AND LIQUID-CRYSTAL DISPLAY DEVICES MADE BY USING THE SAME CHISSO CORPORATION (JP) 1998-12-02 EP disclosed