SCHEMBL25875844

SCHEMBL25875844

C=CC(=O)OCCCc1ccc(-c2ccc3c(c2)oc2c(OC)c(OC(=O)C=C)ccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 5/20 0.37
AKR1B10 O60218 3/20 0.37
AKR1B1 P15121 3/20 0.37
THRB P10828 2/20 0.36
ALOX5 P09917 1/20 0.35
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
MAOA P21397 2/20 0.32
TERT O14746 1/20 0.32
MAOB P27338 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL25874397 0.93 MET (0.39) METAKR1B10AKR1B1THRBALOX5
SCHEMBL25875551 0.89 THRB (0.38) METAKR1B10AKR1B1THRBALOX5
SCHEMBL25876638 0.89 THRB (0.33) METTHRBMMP12MMP13
SCHEMBL25876146 0.87 THRB (0.38) METAKR1B10AKR1B1THRBALOX5
SCHEMBL25875291 0.87 THRB (0.35) METAKR1B10AKR1B1THRBALOX5
SCHEMBL25875107 0.85 THRB (0.40) METAKR1B10AKR1B1THRBALOX5
SCHEMBL25876380 0.85 THRB (0.34) METAKR1B10AKR1B1THRBMMP12
SCHEMBL25875991 0.85 THRB (0.36) METAKR1B10AKR1B1THRBALOX5
SCHEMBL25875842 0.84 ABCG2 (0.38) THRBMAOATERTMAOBALDH1A1
SCHEMBL25875845 0.84 MAOA (0.34) METAKR1B10AKR1B1PDE4APDE4B

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
WO-2023134594-A1 NEGATIVE DIELECTRIC ANISOTROPIC LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIER, AND LIQUID CRYSTAL DISPLAY COMPONENT 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed
WO-2023134595-A1 POLYMERIZABLE COMPOUND, COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed