SCHEMBL25875302

SCHEMBL25875302

C=CC(=O)OCCCc1ccc(-c2ccc3c(oc4c(F)c(OC(=O)C=C)ccc43)c2C)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.36
MPL P40238 1/20 0.32
TYMS P04818 1/20 0.31
MET P08581 3/20 0.31
HPGD P15428 2/20 0.31
TSHR P16473 2/20 0.31
KDM4E B2RXH2 2/20 0.31
AKR1B10 O60218 1/20 0.31
AKR1B1 P15121 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
THRA P10827 1/20 0.30
SLC26A3 P40879 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
SCHEMBL25875557 0.93 THRB (0.36) THRBMPLTYMSMETHPGD
SCHEMBL25875296 0.93 THRB (0.37) THRBMPLTYMSMETHPGD
SCHEMBL25875668 0.93 THRB (0.39) THRBTYMSMETHPGDTSHR
SCHEMBL25875378 0.89 THRB (0.35) THRBTYMSMETAKR1B10AKR1B1
SCHEMBL25876474 0.89 THRB (0.35) THRBTYMSMET
SCHEMBL25875991 0.88 THRB (0.36) THRBTYMSMETHPGDTSHR
SCHEMBL25875448 0.88 THRB (0.33) THRBTYMS
SCHEMBL25876708 0.87 THRB (0.34) THRBTHRA
SCHEMBL25875984 0.86 THRB (0.35) THRBMPLTYMSMETAKR1B10
SCHEMBL25873937 0.85 THRB (0.38) THRBTYMSHPGDTSHRKDM4E

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