SCHEMBL25875111

SCHEMBL25875111

C=CC(=O)Oc1ccc(-c2ccc3c(oc4cc(OC(=O)C=C)ccc43)c2C(F)(F)F)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.36
ALDH1A1 P00352 8/20 0.36
KMT2A Q03164 5/20 0.36
MAPT P10636 3/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
AGER Q15109 2/20 0.35
CA9 Q16790 1/20 0.35
KDM4E B2RXH2 6/20 0.34
GLA P06280 2/20 0.34
GAA P10253 2/20 0.34
HPGD P15428 5/20 0.33
HTT P42858 2/20 0.33
ESR1 P03372 1/20 0.33
GAPDH P04406 1/20 0.33
THRB P10828 1/20 0.33
LMNA P02545 2/20 0.32
MEN1 O00255 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
SCHEMBL25875213 0.87 THRB (0.38) CYP2C9ALDH1A1KMT2AMAPTAGER
SCHEMBL25876562 0.85 TYMS (0.35) CYP2C9THRB
SCHEMBL25873792 0.85 CYP2C9 (0.40) CYP2C9ALDH1A1KMT2AMAPTPPARG
SCHEMBL25875212 0.85 ALDH1A1 (0.38) CYP2C9ALDH1A1KMT2AMAPTPPARG
SCHEMBL25875215 0.85 KMT2A (0.34) ALDH1A1KMT2AMAPTPPARGNCOA2
SCHEMBL25874998 0.84 ALDH1A1 (0.40) ALDH1A1KMT2AMAPTPPARGNCOA2
SCHEMBL25876291 0.83 CYP2C9 (0.35) CYP2C9ALDH1A1KMT2AMAPTPPARG
SCHEMBL25875380 0.83 TYMS (0.33) THRB
SCHEMBL25875781 0.82 KMT2A (0.38) ALDH1A1KMT2AMAPTNPSR1KDM4E
SCHEMBL25875101 0.81 HPGD (0.40) CYP2C9ALDH1A1KMT2AMAPTPPARG

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