SCHEMBL13586159

SCHEMBL13586159

CCOCc1ccc(-c2ccc(CCc3ccc(C4=CCC(OC)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.31
CHKA P35790 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
SCHEMBL13586153 0.91 NAAA (0.33) GRM2
SCHEMBL13586374 0.91 GRM2 (0.31) GRM2
SCHEMBL12718040 0.89 FFAR4 (0.34) GRM2CHKA
SCHEMBL12717803 0.88 CCNT1 (0.33) GRM2CHKA
SCHEMBL12738681 0.88 CHKA (0.31) CHKA
SCHEMBL12717880 0.87 RORC (0.33) CHKA
SCHEMBL13586413 0.83 S1PR1 (0.33) GRM2
SCHEMBL12718735 0.82 CYP24A1 (0.36) GRM2
SCHEMBL12823641 0.81 NAAA (0.39) GRM2
SCHEMBL13586610 0.81 FFAR4 (0.35) CHKA

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