SCHEMBL14767114

SCHEMBL14767114

CCOc1ccc(OC(=O)c2ccc(-c3ccc(-c4ccc(OC)cc4)c(F)c3F)cc2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
THRB P10828 2/20 0.47
TP53 P04637 2/20 0.45
KMT2A Q03164 3/20 0.43
FFAR1 O14842 4/20 0.42
PPARD Q03181 2/20 0.42
BACE1 P56817 1/20 0.40
SYK P43405 1/20 0.40
CYP2C19 P33261 2/20 0.40
GBA1 P04062 1/20 0.40
APP P05067 1/20 0.40
TSHR P16473 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
ALOX12 P18054 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39

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
SCHEMBL13586232 0.93 MAPT (0.45) MAPTTHRBTP53KMT2AFFAR1
SCHEMBL14767299 0.93 MAPT (0.45) MAPTTHRBTP53KMT2AFFAR1
SCHEMBL14766141 0.91 MAPT (0.50) MAPTTHRBTP53KMT2AFFAR1
SCHEMBL12742721 0.91 MAPT (0.43) MAPTTHRBTP53KMT2AFFAR1
SCHEMBL12742738 0.91 THRB (0.43) MAPTTHRBTP53KMT2AFFAR1
SCHEMBL12822923 0.91 MAPT (0.49) MAPTTHRBTP53KMT2AFFAR1
SCHEMBL12742736 0.90 MAPT (0.42) MAPTTHRBTP53KMT2AFFAR1
SCHEMBL12823463 0.90 KMT2A (0.50) MAPTTP53KMT2ABACE1CYP2C19
SCHEMBL14767285 0.89 MAPT (0.46) MAPTTHRBKMT2AFFAR1CYP2C19
SCHEMBL14766010 0.89 MAPT (0.50) MAPTTHRBTP53KMT2ABACE1

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