SCHEMBL8750990

SCHEMBL8750990

COC(C)CCCCc1cc(S(=O)(=O)O)ccc1C

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRAP1 Q12931 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP2C19 P33261 1/20 0.32
S1PR3 Q99500 1/20 0.32
TBXAS1 P24557 1/20 0.31
FUT7 Q11130 1/20 0.31
MMP1 P03956 2/20 0.31
MMP2 P08253 2/20 0.31
MMP3 P08254 2/20 0.31
PDE4A P27815 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
SNCA P37840 1/20 0.31
LTB4R Q15722 2/20 0.31
CASR P41180 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL8991760 0.82 S1PR3 (0.44) S1PR3MMP1MMP3ALDH1A1LMNA
SCHEMBL8686868 0.82 CYP1A2 (0.37) CYP1A2CYP3A4CYP2D6ALOX15CYP2C19
SCHEMBL8686442 0.82 CYP1A2 (0.37) CYP1A2CYP3A4CYP2D6ALOX15CYP2C19
SCHEMBL9812256 0.82 ALDH1A1 (0.34) CYP1A2CYP3A4CYP2D6ALOX15CYP2C19
SCHEMBL10598218 0.81 SNCA (0.39) CYP2C19S1PR3SNCAALDH1A1LMNA
SCHEMBL8750988 0.80 S1PR3 (0.41) S1PR3ALDH1A1MAPT
SCHEMBL10317771 0.79 S1PR3 (0.37) S1PR3SNCAALDH1A1MAPT
SCHEMBL16028578 0.79 CA2 (0.42) S1PR3SNCAALDH1A1LMNAMAPT
SCHEMBL10652394 0.79 S1PR3 (0.45) CYP3A4ALOX15S1PR3ALDH1A1LMNA
SCHEMBL8838182 0.78 CA2 (0.42) S1PR3FUT7MMP1MMP2MMP3

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0440136-B1 Liquid crystal composition and liquid crystal device containing the same CANON KK (JP) 1997-04-02 EP disclosed
US-5599479-A Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1997-02-04 US disclosed
US-5580489-A MIXING OPTICALLY ACTIVE AND INACTIVE COMPOUNDS CANON KABUSHIKI KAISHA (JP) 1996-12-03 US disclosed
US-5501818-A PYRIMIDINE COMPOUNDS, IMPROVED RESPONSE SPEED WITH LESS TEMPERATURE DEPENDENCE CANON KABUSHIKI KAISHA (JP) 1996-03-26 US disclosed
EP-0401522-B1 Liquid crystal composition and liquid crystal device using same CANON KK (JP) 1995-12-06 EP disclosed
US-5409636-A Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1995-04-25 US disclosed
US-5405553-A Comprising at least one optical active dialkylphenylpyrimidine compound; improve response; displaying shutters CANON KABUSHIKI KAISHA (JP) 1995-04-11 US disclosed
EP-0352480-B1 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KK (JP) 1995-03-22 EP disclosed
US-5391318-A Liquid crystal composition and liquid crystal device containing the same CANON KABUSHIKI KAISHA (JP) 1995-02-21 US disclosed
EP-0347944-B1 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KK (JP) 1995-02-01 EP disclosed
EP-0440136-A2 Liquid crystal composition and liquid crystal device containing the same CANON KABUSHIKI KAISHA (JP) 1991-08-07 EP disclosed
EP-0401522-A1 Liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1990-12-12 EP disclosed
EP-0356672-A1 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1990-03-07 EP disclosed
EP-0355313-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1990-02-28 EP disclosed
EP-0352479-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1990-01-31 EP disclosed
EP-0352480-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1990-01-31 EP disclosed
EP-0350937-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1990-01-17 EP disclosed
EP-0347943-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1989-12-27 EP disclosed
EP-0347944-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1989-12-27 EP disclosed
EP-0347940-A2 Ferroelectric chiral smectic liquid crystal composition and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1989-12-27 EP disclosed