SCHEMBL6583266

SCHEMBL6583266

COc1cc(CCCC2OC(=O)NC2=O)cc(OC)c1OCc1coc(C=Cc2ccccc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.48
ERBB2 P04626 3/20 0.35
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33
TUBB4A P04350 2/20 0.33
TUBB P07437 2/20 0.33
TUBA3C P0DPH7 2/20 0.33
TUBA1B P68363 2/20 0.33
TUBA4A P68366 2/20 0.33
TUBB4B P68371 2/20 0.33
TUBB3 Q13509 2/20 0.33
TUBB2A Q13885 2/20 0.33
TUBB8 Q3ZCM7 2/20 0.33
TUBA3E Q6PEY2 2/20 0.33
TUBA1A Q71U36 2/20 0.33
TUBA1C Q9BQE3 2/20 0.33
TUBB6 Q9BUF5 2/20 0.33
TUBB2B Q9BVA1 2/20 0.33
TUBB1 Q9H4B7 2/20 0.33
MINK1 Q8N4C8 1/20 0.32

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
SCHEMBL6583256 1.00 PPARG (0.48) PPARGERBB2PDGFRBPDGFRATUBB4A
SCHEMBL6584250 0.91 PPARG (0.58) PPARGERBB2PDGFRBPDGFRATUBB4A
SCHEMBL6584259 0.91 PPARG (0.58) PPARGERBB2PDGFRBPDGFRATUBB4A
SCHEMBL6585075 0.89 PPARG (0.55) PPARGERBB2PDGFRBPDGFRATUBB4A
SCHEMBL6585081 0.89 PPARG (0.55) PPARGERBB2PDGFRBPDGFRATUBB4A
SCHEMBL8888304 0.85 ERBB2 (0.44) PPARGERBB2MINK1CYP4F2CYP4A11
SCHEMBL8888314 0.85 ERBB2 (0.44) PPARGERBB2MINK1CYP4F2CYP4A11
SCHEMBL6968711 0.85 PTPN1 (0.37) PPARGERBB2MINK1KMT2AMMP2
SCHEMBL6583264 0.84 ERBB2 (0.35) PPARGERBB2PDGFRBPDGFRATUBB4A
SCHEMBL8898503 0.84 ERBB2 (0.38) PPARGERBB2PDGFRBPDGFRATUBB4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0710659-A1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP claimed
EP-0710659-B1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-01-28 EP disclosed
EP-0893995-B1 ANTICACHECTIC COMPOSITION TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-12-10 EP disclosed
US-6365607-B1 Anticachectic composition TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-04-02 US disclosed
US-6110948-A Anticachectic composition TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-08-29 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