SCHEMBL14766560

SCHEMBL14766560

CCCCOc1ccc(-c2ccc(C3CCC(COc4ccc(OCCCC)cc4F)CC3)c(F)c2F)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.42
PPARD Q03181 8/20 0.42
FFAR4 Q5NUL3 4/20 0.38
PPARA Q07869 1/20 0.37
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
KDM1A O60341 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
CRBN Q96SW2 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL14767042 0.98 FFAR1 (0.41) FFAR1PPARDFFAR4PPARARARA
SCHEMBL14767084 0.97 FFAR1 (0.41) FFAR1PPARDFFAR4PPARAPDE4D
SCHEMBL14766762 0.97 FFAR1 (0.44) FFAR1PPARDFFAR4PPARAKDM1A
SCHEMBL14766677 0.95 FFAR1 (0.42) FFAR1PPARDFFAR4PPARAKDM1A
SCHEMBL12740792 0.95 PPARD (0.40) FFAR1PPARDFFAR4PPARAKDM1A
SCHEMBL14766733 0.95 FFAR1 (0.42) FFAR1PPARDFFAR4PPARAKDM1A
SCHEMBL12740794 0.93 PPARD (0.39) FFAR1PPARDFFAR4PPARAKDM1A
SCHEMBL14767103 0.93 FFAR1 (0.38) FFAR1PPARDFFAR4PPARARARA
SCHEMBL14767125 0.93 FFAR1 (0.38) FFAR1PPARDFFAR4PPARAALOX5AP
SCHEMBL12740795 0.93 PPARD (0.38) FFAR1PPARDFFAR4PPARAKDM1A

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
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed