SCHEMBL14766216

SCHEMBL14766216

C=CCCOc1ccc(-c2ccc(C(=O)Oc3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
FFAR1 O14842 5/20 0.40
PPARD Q03181 4/20 0.40
TP53 P04637 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
KMT2A Q03164 2/20 0.38
S1PR1 P21453 1/20 0.37
THRB P10828 2/20 0.37
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 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
SCHEMBL14766408 0.95 RARB (0.42) MAPTFFAR1FFAR4KMT2AS1PR1
SCHEMBL14767240 0.93 KMT2A (0.41) MAPTFFAR1PPARDTP53FFAR4
SCHEMBL14766478 0.92 MAPT (0.42) MAPTFFAR1TP53FFAR4KMT2A
SCHEMBL14767313 0.92 MAPT (0.42) MAPTFFAR1TP53FFAR4KMT2A
SCHEMBL14766452 0.92 RARB (0.42) MAPTFFAR1FFAR4KMT2AS1PR1
SCHEMBL14767128 0.91 KMT2A (0.41) MAPTFFAR1PPARDFFAR4KMT2A
SCHEMBL14767262 0.91 FFAR1 (0.44) MAPTFFAR1PPARDTP53FFAR4
SCHEMBL14766535 0.91 MAPT (0.44) MAPTFFAR1PPARDTP53FFAR4
SCHEMBL12737541 0.91 TP53 (0.37) MAPTTP53FFAR4KMT2AS1PR1
SCHEMBL14766369 0.90 FFAR1 (0.44) MAPTFFAR1PPARDTP53FFAR4

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