SCHEMBL6580905

SCHEMBL6580905

COc1cc(CCCC2OCCO2)ccc1OCc1nc(-c2ccccc2)oc1C

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.53
FFAR1 O14842 1/20 0.48
KDR P35968 1/20 0.47
MAPT P10636 2/20 0.44
PPARA Q07869 6/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
USP2 O75604 2/20 0.42
LMNA P02545 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42

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
SCHEMBL6584386 0.96 PPARG (0.49) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6584539 0.96 PPARG (0.49) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6582673 0.94 FFAR1 (0.49) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6583469 0.86 KDR (0.44) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6583779 0.85 KDR (0.53) PPARGFFAR1KDRMAPTPPARA
SCHEMBL4038141 0.82 KDR (0.67) PPARGFFAR1KDRMAPTPPARA
SCHEMBL4727180 0.82 PPARG (0.57) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6585532 0.81 PPARG (0.79) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6585536 0.81 PPARG (0.56) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6583875 0.81 PPARG (0.49) PPARGFFAR1KDRMAPTPPARA

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
EP-0710659-B1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-01-28 EP disclosed
EP-0710659-A1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP disclosed