SCHEMBL25008933

SCHEMBL25008933

C=CC(=O)OCCCCOc1ccc(NNc2ccc(NNc3ccc(OCCCCOC(=O)C=C)c(C)c3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
TSHR P16473 2/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 4/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 1/20 0.41
PPARG P37231 2/20 0.40
PPARD Q03181 2/20 0.40
PPARA Q07869 1/20 0.40
HDAC6 Q9UBN7 1/20 0.39
MAPT P10636 1/20 0.39
WDR5 P61964 2/20 0.38
HTT P42858 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL25008939 0.88 THRB (0.45) THRBTSHRHPGDKDM4EALDH1A1
SCHEMBL25008931 0.86 THRB (0.58) THRBTSHRHPGDKDM4EALDH1A1
SCHEMBL2404069 0.84 PPARD (0.51) THRBTSHRHPGDKDM4ELMNA
SCHEMBL29930734 0.84 PPARD (0.51) THRBTSHRHPGDKDM4ELMNA
SCHEMBL25008936 0.84 THRB (0.45) THRBTSHRHPGDKDM4EALDH1A1
SCHEMBL25008930 0.84 TSHR (0.46) TSHRHPGDALDH1A1MAPTTP53
SCHEMBL25008934 0.83 THRB (0.42) THRBTSHRHPGDKDM4ELMNA
SCHEMBL25008937 0.82 THRB (0.52) THRBTSHRHPGDLMNAALDH1A1
SCHEMBL23730215 0.82 TSHR (0.50) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL20781163 0.81 PPARA (0.47) THRBTSHRHPGDKDM4ELMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230039106-A1 LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-02-09 US disclosed