SCHEMBL25879495

SCHEMBL25879495

C=CC(=O)OCCCc1ccc2c(c1)oc1cc(OC(=O)C=C)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.46
TSHR P16473 4/20 0.39
HPGD P15428 3/20 0.39
ALDH1A1 P00352 8/20 0.39
CYP3A4 P08684 1/20 0.39
HSD17B10 Q99714 3/20 0.36
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
MET P08581 3/20 0.35
KMT2A Q03164 4/20 0.35
RXFP1 Q9HBX9 2/20 0.35
MAPT P10636 1/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 4/20 0.35
GLA P06280 3/20 0.35
GAA P10253 3/20 0.35
USP2 O75604 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL25873666 0.92 THRB (0.46) THRBTSHRHPGDALDH1A1HSD17B10
SCHEMBL25874988 0.91 THRB (0.45) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL803488 0.84 THRB (0.49) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL31092348 0.84 THRB (0.49) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL25904336 0.84 THRB (0.46) THRBTSHRHPGDALDH1A1HSD17B10
SCHEMBL25875096 0.83 THRB (0.42) THRBTSHRHPGDALDH1A1HSD17B10
SCHEMBL25874993 0.82 THRB (0.39) THRBTSHRHPGDALDH1A1KMT2A
SCHEMBL25873866 0.82 THRB (0.36) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL25874108 0.82 THRB (0.38) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL25867806 0.81 THRB (0.46) THRBTSHRHPGDALDH1A1CYP3A4

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