SCHEMBL25874111

SCHEMBL25874111

C=CC(=O)OCCCc1ccc2c(oc3c(C)c(OC(=O)C=C)ccc32)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.38
THRA P10827 1/20 0.38
ALDH1A1 P00352 7/20 0.36
HPGD P15428 5/20 0.36
TSHR P16473 5/20 0.36
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 3/20 0.36
LMNA P02545 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
CYP3A4 P08684 1/20 0.34
GBA1 P04062 1/20 0.33
TYMS P04818 1/20 0.33
MAPT P10636 2/20 0.32
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31

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
SCHEMBL25873937 0.93 THRB (0.38) THRBTHRAALDH1A1HPGDTSHR
SCHEMBL25873868 0.93 THRB (0.38) THRBTHRAALDH1A1HPGDTSHR
SCHEMBL25874212 0.91 THRB (0.41) THRBTHRAALDH1A1HPGDTSHR
SCHEMBL25874401 0.89 THRB (0.36) THRBTHRAALDH1A1HPGDTSHR
SCHEMBL25874325 0.88 THRB (0.37) THRBTHRAALDH1A1HPGDTSHR
SCHEMBL25874627 0.87 THRB (0.34) THRBTHRAALDH1A1HPGDTSHR
SCHEMBL25874216 0.87 THRB (0.38) THRBTHRAALDH1A1HPGDTSHR
SCHEMBL25875557 0.86 THRB (0.36) THRBTHRAALDH1A1HPGDTSHR
SCHEMBL25874775 0.85 THRB (0.35) THRBTHRAALDH1A1TSHRCYP3A4
SCHEMBL25874021 0.85 THRB (0.36) THRBTHRAALDH1A1HPGDTSHR

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-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
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