SCHEMBL6583873

SCHEMBL6583873

COc1cc(C=CC=C2OC(=O)NC2=O)ccc1OC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 2/20 0.42
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
PDE4A P27815 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
DNMT1 P26358 1/20 0.38
PIM1 P11309 1/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
GAA P10253 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 1/20 0.37
CYP1A1 P04798 2/20 0.36

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
SCHEMBL6583878 1.00 PDE4B (0.43) PDE4BKMT2AMEN1HDAC1HDAC2
SCHEMBL6583882 0.84 PDE4B (0.46) PDE4BKMT2AMEN1HDAC1HDAC2
SCHEMBL8188195 0.80 MEN1 (0.55) KMT2AMEN1HDAC1HDAC2HDAC8
SCHEMBL8226071 0.79 KMT2A (0.40) KMT2AMEN1DNMT1GAAALDH1A1
SCHEMBL8226070 0.79 KMT2A (0.40) KMT2AMEN1DNMT1GAAALDH1A1
SCHEMBL6972871 0.78 PDE4B (0.58) PDE4BKMT2AMEN1PIM1PIM3
SCHEMBL6972866 0.78 PDE4B (0.58) PDE4BKMT2AMEN1PIM1PIM3
SCHEMBL8172495 0.78 XDH (0.53) KMT2AMEN1HDAC1HDAC2HDAC8
SCHEMBL8172492 0.78 XDH (0.53) KMT2AMEN1HDAC1HDAC2HDAC8
SCHEMBL8186829 0.78 MEN1 (0.52) PDE4BKMT2AMEN1PDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0710659-B1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-01-28 EP disclosed
US-5932601-A USEFUL FOR LOWERING BLOOD SUGAR AND LIPID IN BLOOD TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-08-03 US disclosed
WO-1997000249-A1 HETEROCYCLIC COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-01-03 WO disclosed
EP-0710659-A1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP disclosed