SCHEMBL14765827

SCHEMBL14765827

CCOc1ccc(-c2ccc(COC3CCC(c4ccc(OCC)c(F)c4F)CC3)c(F)c2F)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.38
FFAR4 Q5NUL3 4/20 0.35
ESR1 P03372 1/20 0.34
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FPR2 P25090 2/20 0.32
ALOX5AP P20292 3/20 0.32
FEN1 P39748 3/20 0.32
RET P07949 1/20 0.31
HTR1A P08908 1/20 0.31
FFAR1 O14842 2/20 0.31
PPARD Q03181 1/20 0.31
MAPT P10636 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL14766585 1.00 NAAA (0.38) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL14766582 0.94 NAAA (0.36) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL14766099 0.94 NAAA (0.36) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL14766735 0.94 FFAR4 (0.38) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL12822777 0.94 NAAA (0.37) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL12821200 0.94 NAAA (0.37) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL14766520 0.94 FFAR4 (0.38) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL12740309 0.92 NAAA (0.38) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL12736734 0.92 NAAA (0.38) NAAAFFAR4ESR1FGFR1FGFR2
SCHEMBL14766471 0.91 GYS1 (0.34) NAAAFFAR4MAPT

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