SCHEMBL10189919

SCHEMBL10189919

O=S(=O)(O)c1ccc(OCC(F)F)c(OCC(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR3 Q99500 1/20 0.40
DRD2 P14416 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
HSD17B10 Q99714 5/20 0.37
ALDH1A1 P00352 7/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
CASR P41180 1/20 0.35
LMNA P02545 1/20 0.34
TSHR P16473 3/20 0.33
KDM4E B2RXH2 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP17A1 P05093 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
NT5E P21589 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
HTR2A P28223 2/20 0.33

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
SCHEMBL14542188 0.86 ALDH1A1 (0.45) S1PR3ALDH1A1LMNATSHRCYP17A1
Hydrochloric Acid SCHEMBL28283255 0.76 CA1 (0.43) ALDH1A1LMNATSHRTDP1NT5E
SCHEMBL26041052 0.75 S1PR3 (0.57) S1PR3HSD17B10ALDH1A1LMNATSHR
SCHEMBL12925294 0.74 MRGPRX4 (0.40) S1PR3HSD17B10ALDH1A1MRGPRX4CASR
SCHEMBL1108094 0.72 MAPT (0.48) S1PR3HSD17B10ALDH1A1MRGPRX4LMNA
SCHEMBL1108076 0.72 MAPT (0.48) S1PR3HSD17B10ALDH1A1MRGPRX4LMNA
SCHEMBL1108102 0.72 MAPT (0.48) S1PR3HSD17B10ALDH1A1MRGPRX4LMNA
SCHEMBL13989471 0.71 S1PR3 (0.50) S1PR3HSD17B10ALDH1A1LMNATSHR
SCHEMBL1108075 0.71 S1PR3 (0.72) S1PR3ALDH1A1LMNAMAPK1HPGD
SCHEMBL18267872 0.70 S1PR3 (0.52) S1PR3HSD17B10ALDH1A1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153246-B2 Optical compensatory film, polarizing plate, and liquid crystal display device FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-7658864-B2 Liquid crystal composition, optical compensation film and liquid crystal display device FUJIFILM CORPORATION (JP) 2010-02-09 US disclosed
US-20090273740-A1 OPTICAL COMPENSATORY FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2009-11-05 US disclosed
US-20090040435-A1 LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2009-02-12 US disclosed
US-20090009693-A1 Liquid Crystal Composition, Optical Compensation Film and Liquid Crystal Display Device FUJIFILM CORPORATION (JP) 2009-01-08 US disclosed