SCHEMBL14765804

SCHEMBL14765804

C=CCCOc1ccc(C2CCC(COc3ccc(-c4ccc(OCCCC)cc4)c(F)c3F)CC2)cc1F

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.36
FFAR1 O14842 3/20 0.33
PPARD Q03181 2/20 0.33
CNR2 P34972 2/20 0.32
KDM1A O60341 2/20 0.32
PPARG P37231 2/20 0.31
PPARA Q07869 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
RAB9A P51151 1/20 0.31
CNR1 P21554 1/20 0.31
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31

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
SCHEMBL14766443 0.97 FFAR4 (0.37) FFAR4FFAR1PPARDCNR2KDM1A
SCHEMBL14765785 0.95 FFAR4 (0.35) FFAR4FFAR1PPARDKDM1APPARG
SCHEMBL14766040 0.93 FFAR4 (0.38) FFAR4FFAR1PPARDKDM1APPARG
SCHEMBL14766059 0.91 FFAR4 (0.37) FFAR4FFAR1PPARDKDM1APPARG
SCHEMBL14766067 0.90 KDM1A (0.40) FFAR4FFAR1PPARDKDM1ARAB9A
SCHEMBL12736145 0.90 FFAR4 (0.36) FFAR4FFAR1PPARDKDM1A
SCHEMBL14765682 0.89 CNR2 (0.34) FFAR4CNR2KDM1APPARGPPARA
SCHEMBL14766672 0.88 ALOX5AP (0.32) FFAR4CNR2GABRA1GABRB2CNR1
SCHEMBL14765842 0.88 ALOX5AP (0.32) FFAR4CNR2GABRA1GABRB2CNR1
SCHEMBL12736150 0.88 FFAR4 (0.38) FFAR4FFAR1PPARDKDM1A

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