SCHEMBL4558336

SCHEMBL4558336

FC(F)(F)c1cc(Nc2ccccc2)ccc1-c1ccc(Nc2ccccc2)cc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.51
ALDH1A1 P00352 4/20 0.50
HSD17B10 Q99714 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
TSHR P16473 3/20 0.50
MAPT P10636 3/20 0.50
ALOX15 P16050 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALOX12 P18054 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
MAPK1 P28482 1/20 0.50
PTGS2 P35354 1/20 0.50
HTR2B P41595 1/20 0.50
AR P10275 1/20 0.50
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
CYP3A4 P08684 4/20 0.47

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
SCHEMBL26037582 0.83 APP (0.49) TSHRMAPTMEN1KMT2AL3MBTL1
SCHEMBL13429480 0.81 TAS2R14 (0.62) PDK2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL28744365 0.81 RAPGEF4 (0.58) ALDH1A1HSD17B10TDP1TSHRMAPT
SCHEMBL11084966 0.78 CNR2 (0.43) PDK2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL12541880 0.74 POLB (0.54) ALDH1A1TDP1TSHRMAPTL3MBTL1
SCHEMBL23638848 0.74 ALDH1A1 (0.56) PDK2ALDH1A1HSD17B10TDP1TSHR
SCHEMBL24219958 0.73 AR (0.42) ALDH1A1HSD17B10TDP1TSHRALOX15
SCHEMBL23560453 0.73 GLA (0.49) ALDH1A1TSHRMAPTALOX12L3MBTL1
SCHEMBL6215723 0.73 S1PR1 (0.49) PDK2
SCHEMBL503225 0.73 ALDH1A1 (0.62) ALDH1A1HSD17B10TDP1TSHRMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7535531-B2 Birefringent optical film, laminated polarizing plate, liquid crystal display and image NITTO DENKO CORPORATION (JP) 2009-05-19 US disclosed
US-20060072221-A1 Birefringence optical film NITTO DENKO CORPORATION (JP) 2006-04-06 US disclosed