SCHEMBL14767306

SCHEMBL14767306

C=CCCOc1ccc(C(=O)Oc2ccc(-c3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.46
FFAR1 O14842 2/20 0.46
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
MAPT P10636 2/20 0.38
THRB P10828 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
LSS P48449 1/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MCL1 Q07820 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
CPS1 P31327 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
SCHEMBL14766525 0.94 FFAR4 (0.44) FFAR4FFAR1RARARARBMAPT
SCHEMBL14767281 0.94 RARA (0.46) FFAR4FFAR1RARARARBLMNA
SCHEMBL14766716 0.92 RARA (0.46) FFAR4FFAR1RARARARBLMNA
SCHEMBL12742004 0.91 MAPT (0.41) FFAR4FFAR1RARARARBMAPT
SCHEMBL14766892 0.90 FFAR4 (0.43) FFAR4FFAR1RARARARBMAPT
SCHEMBL14767124 0.89 FFAR4 (0.49) FFAR4FFAR1RARARARBMAPT
SCHEMBL14767280 0.89 FFAR4 (0.53) FFAR4FFAR1RARARARBMAPT
SCHEMBL14766917 0.88 RARA (0.42) FFAR4FFAR1RARARARBLMNA
SCHEMBL12742006 0.88 MAPT (0.40) FFAR4FFAR1RARARARBMAPT
SCHEMBL12823909 0.87 CASR (0.37) FFAR4FFAR1RARARARBKMT2A

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