SCHEMBL14766202

SCHEMBL14766202

C=CCOc1ccc(-c2ccc(OCc3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.42
PPARD Q03181 5/20 0.42
NAAA Q02083 1/20 0.38
CACNA1C Q13936 1/20 0.37
MGAM O43451 3/20 0.36
GAA P10253 3/20 0.36
SI P14410 3/20 0.36
MGAM2 Q2M2H8 3/20 0.36
GYS1 P13807 2/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
FFAR4 Q5NUL3 2/20 0.34
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL12737098 0.92 FFAR1 (0.39) FFAR1PPARDMGAMGAASI
SCHEMBL14767013 0.91 MGAM (0.37) FFAR1PPARDCACNA1CMGAMGAA
SCHEMBL14766157 0.91 MGAM (0.37) FFAR1PPARDCACNA1CMGAMGAA
SCHEMBL14765983 0.90 FFAR1 (0.47) FFAR1PPARDNAAACACNA1CGYS1
SCHEMBL14765998 0.90 FFAR1 (0.41) FFAR1PPARDNAAACACNA1CPPARG
SCHEMBL14765756 0.89 FFAR1 (0.38) FFAR1PPARDNAAAMGAMGAA
SCHEMBL14765867 0.88 FFAR1 (0.44) FFAR1PPARDNAAAMGAMGAA
SCHEMBL12737085 0.88 FFAR1 (0.40) FFAR1PPARDNAAACACNA1CGYS1
SCHEMBL12823285 0.87 MGAM (0.35) FFAR1PPARDMGAMGAASI
SCHEMBL14766680 0.86 FFAR1 (0.48) FFAR1PPARDMGAMGAASI

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