SCHEMBL28053727

SCHEMBL28053727

FC(F)(F)c1ccccc1-c1ccccc1.FCF

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.54
HSD11B1 P28845 2/20 0.50
AR P10275 1/20 0.47
SLC13A5 Q86YT5 1/20 0.47
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
SCN9A Q15858 2/20 0.46
CNR2 P34972 4/20 0.46
DPP4 P27487 1/20 0.45
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
BACE1 P56817 1/20 0.42
TRPA1 O75762 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
MME P08473 1/20 0.42

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
SCHEMBL163729 0.93 HSD11B1 (0.55) FFAR4HSD11B1ARSLC13A5PPARG
Water SCHEMBL27916635 0.91 AR (0.55) FFAR4HSD11B1ARSLC13A5PPARG
Methane SCHEMBL28022370 0.91 HSD11B1 (0.53) FFAR4HSD11B1ARSLC13A5PPARG
Hydrogen Sulfide SCHEMBL27686805 0.91 HSD11B1 (0.53) FFAR4HSD11B1ARSLC13A5PPARG
Ethyne SCHEMBL27849625 0.91 HSD11B1 (0.53) FFAR4HSD11B1ARSLC13A5PPARG
Ammonia Solution, Strong SCHEMBL28126322 0.91 HSD11B1 (0.53) FFAR4HSD11B1ARSLC13A5PPARG
Water SCHEMBL7091891 0.91 AR (0.55) FFAR4HSD11B1ARSLC13A5PPARG
SCHEMBL5523215 0.89 KIF11 (0.54) FFAR4HSD11B1ARSLC13A5PPARG
SCHEMBL11286015 0.89 KIF11 (0.54) FFAR4HSD11B1ARSLC13A5PPARG
SCHEMBL29980535 0.89 KIF11 (0.54) FFAR4HSD11B1ARSLC13A5PPARG

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
CN-103459467-B Polybenzoxazole resin and precursor thereof MITSUBISHI GAS CHEMICAL CO.,INC. (JP) 2016-04-06 CN disclosed