SCHEMBL25875839

SCHEMBL25875839

C=CC(=O)OCCCc1ccc(-c2ccc3c(oc4c(C)c(OC(=O)C=C)ccc43)c2OC(F)(F)F)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.34
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
ESR1 P03372 1/20 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
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
THRA P10827 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
SCHEMBL25876708 0.93 THRB (0.34) THRBESR1THRA
SCHEMBL25876854 0.93 THRB (0.34) THRBAKR1B10AKR1B1THRA
SCHEMBL25876289 0.92 AKR1B10 (0.34) THRBAKR1B10AKR1B1
SCHEMBL25875454 0.91 THRB (0.32) THRB
SCHEMBL25876791 0.90 THRB (0.34) THRBAKR1B10AKR1B1THRA
SCHEMBL25876569 0.90 THRB (0.32) THRB
SCHEMBL25875674 0.90 THRB (0.36) THRBKDM4EAKR1B10AKR1B1ALDH1A1
SCHEMBL25875668 0.89 THRB (0.39) THRBKDM4EAKR1B10AKR1B1ALDH1A1
SCHEMBL25875783 0.88 THRB (0.35) THRBPPARDPPARAKDM4EALDH1A1
SCHEMBL25876702 0.87 THRB (0.32) THRB

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