SCHEMBL13586178

SCHEMBL13586178

CCCC(O)c1ccc(-c2ccc(CCc3ccc(-c4ccc(C5CO5)cc4F)cc3)c(F)c2F)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.33
APP P05067 1/20 0.32
HTR2A P28223 1/20 0.30
GRM2 Q14416 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
SCHEMBL12822749 0.94 FFAR4 (0.32) RARB
SCHEMBL13654129 0.90 RARB (0.34) RARBHTR2AGRM2
SCHEMBL12718526 0.89 APP (0.36) RARBAPPHTR2AGRM2
SCHEMBL12822940 0.87 RARB (0.36) RARBHTR2AGRM2
SCHEMBL12822653 0.87 CHKA (0.31)
SCHEMBL12718442 0.87 CHKA (0.31)
SCHEMBL12823306 0.86 BRD4 (0.30) RARB
SCHEMBL13586291 0.85 RARB (0.34) RARBHTR2AGRM2
SCHEMBL12994311 0.85 RARB (0.37) RARBHTR2AGRM2
SCHEMBL12821187 0.84 PDE4A (0.34) APP

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