SCHEMBL14766302

SCHEMBL14766302

CCOc1ccc(-c2ccc(C(=O)Oc3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
THRB P10828 2/20 0.41
FFAR4 Q5NUL3 2/20 0.41
FFAR1 O14842 1/20 0.41
KDM4E B2RXH2 2/20 0.41
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
LMNA P02545 3/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
RECQL P46063 1/20 0.39
ALOX15 P16050 1/20 0.39
TP53 P04637 2/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38

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
SCHEMBL14767278 1.00 MAPT (0.41) MAPTTHRBFFAR4FFAR1KDM4E
SCHEMBL14766096 0.93 RARB (0.43) MAPTTHRBFFAR4FFAR1LMNA
SCHEMBL14767200 0.93 RARB (0.43) MAPTTHRBFFAR4FFAR1LMNA
SCHEMBL12738130 0.93 MAPT (0.42) MAPTTHRBFFAR4FFAR1KDM4E
SCHEMBL12741758 0.93 MAPT (0.40) MAPTTHRBFFAR4FFAR1KDM4E
SCHEMBL12738119 0.93 MAPT (0.40) MAPTTHRBFFAR4FFAR1KDM4E
SCHEMBL12719597 0.93 KDM4E (0.42) MAPTTHRBKDM4EKMT2AGAA
SCHEMBL12823539 0.93 KDM4E (0.42) MAPTTHRBKDM4EKMT2AGAA
SCHEMBL12741776 0.93 MAPT (0.42) MAPTTHRBFFAR4FFAR1KDM4E
SCHEMBL12738129 0.92 MAPT (0.40) MAPTTHRBFFAR4FFAR1KDM4E

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