SCHEMBL29720690

SCHEMBL29720690

C=CC(=O)OCCOc1ccc(C2(c3ccc(OCCOC(=O)C=C)c(CC)c3)c3ccccc3-c3ccccc32)cc1CC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.45
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
L3MBTL1 Q9Y468 5/20 0.35
MAPK1 P28482 1/20 0.35
THRA P10827 1/20 0.35
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 5/20 0.34
LMNA P02545 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TSHR P16473 3/20 0.33
HPGD P15428 1/20 0.33
LTB4R Q15722 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PTPN11 Q06124 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL557484 1.00 THRB (0.45) THRBESR1ESR2L3MBTL1MAPK1
SCHEMBL15356206 0.92 THRB (0.42) THRBESR1ESR2L3MBTL1MAPK1
SCHEMBL819037 0.89 THRB (0.49) THRBESR1ESR2MAPTNPSR1
SCHEMBL30390791 0.89 THRB (0.49) THRBESR1ESR2MAPTNPSR1
SCHEMBL556299 0.88 THRB (0.46) THRBESR1ESR2L3MBTL1MAPK1
SCHEMBL29720691 0.88 THRB (0.46) THRBESR1ESR2L3MBTL1MAPK1
SCHEMBL15356208 0.88 THRB (0.46) THRBTHRATSHRHPGDMEN1
SCHEMBL26115297 0.85 L3MBTL1 (0.35) ESR1ESR2L3MBTL1MAPK1ALDH1A1
SCHEMBL15356189 0.85 THRB (0.46) THRBESR1ESR2L3MBTL1THRA
SCHEMBL4948908 0.85 ESR1 (0.37) THRBESR1ESR2L3MBTL1MAPK1

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
WO-2022154042-A1 VOLUME HOLOGRAM LAMINATE, VOLUME HOLOGRAM TRANSFER FOIL, VOLUME HOLOGRAM LABEL, CARD, DATA PAGE AND BOOK 大日本印刷株式会社 2022-07-21 WO disclosed