SCHEMBL13653969

SCHEMBL13653969

CCOc1ccc(C2CCC(COc3ccc(C(C)O)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 11/20 0.42
▸ CNR2 P34972 1/20 0.38
▸ GPR119 Q8TDV5 1/20 0.38
▸ ACACB O00763 3/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PPARD Q03181 2/20 0.36

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
SCHEMBL10303247 0.90 FFAR1 (0.39) FFAR1CNR2GPR119ACACBPDE4D
SCHEMBL10303129 0.89 FFAR1 (0.39) FFAR1CNR2ACACBPDE4DPDE4B
SCHEMBL10303246 0.89 FFAR1 (0.38) FFAR1GPR119ACACBPPARD
SCHEMBL12907931 0.88 MAOA (0.36) FFAR1GPR119ACACB
SCHEMBL12823094 0.88 FFAR1 (0.43) FFAR1CNR2GPR119ACACBPDE4D
SCHEMBL10303165 0.88 FFAR1 (0.42) FFAR1ACACBPPARD
SCHEMBL10302846 0.87 CNR2 (0.40) FFAR1CNR2PDE4DPDE4B
SCHEMBL12223501 0.87 CNR2 (0.40) FFAR1CNR2PDE4DPDE4B
SCHEMBL11939798 0.86 FFAR4 (0.36) FFAR1CNR2GPR119
SCHEMBL10303229 0.86 FFAR1 (0.41) FFAR1PDE4DPDE4BPPARD

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
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