SCHEMBL13654154

SCHEMBL13654154

CCCc1ccc(COc2ccc(-c3ccc(C4CO4)cc3F)cc2)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 11/20 0.39
MAOB P27338 3/20 0.33
FFAR1 O14842 2/20 0.33
GYS1 P13807 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRD1 P41143 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
SCHEMBL12822641 0.92 FFAR4 (0.43) FFAR4MAOBFFAR1GYS1
SCHEMBL13654169 0.91 FFAR4 (0.41) FFAR4MAOBFFAR1GYS1NPC1
SCHEMBL12823232 0.88 FFAR4 (0.40) FFAR4MAOBFFAR1GYS1NPC1
SCHEMBL13586619 0.88 FFAR4 (0.44) FFAR4MAOBFFAR1GYS1
SCHEMBL13654156 0.86 FFAR4 (0.39) FFAR4GYS1
SCHEMBL12907909 0.85 FFAR4 (0.35) FFAR4MAOBGYS1
SCHEMBL12994311 0.84 RARB (0.37) FFAR4CTSLCTSSCTSK
SCHEMBL10303315 0.84 FFAR4 (0.37) FFAR4MAOBFFAR1GYS1
SCHEMBL12907905 0.84 FFAR4 (0.37) FFAR4MAOBFFAR1GYS1NPC1
SCHEMBL10303334 0.83 FFAR4 (0.36) FFAR4MAOBGYS1NPC1RAB9A

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-2009125668-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE チッソ株式会社 (JP) 2009-10-15 WO disclosed