SCHEMBL6587649

SCHEMBL6587649

COc1ccc(CCCC2OC(=O)NC2=O)cc1OCc1nc(-c2ccccc2)oc1C

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.74
FFAR1 O14842 1/20 0.44
KDR P35968 1/20 0.41
MAPT P10636 2/20 0.41
PPARA Q07869 8/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
KCNH2 Q12809 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL6585532 0.97 PPARG (0.79) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6587021 0.94 PPARG (0.75) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6583693 0.94 PPARG (0.74) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6584159 0.94 PPARG (0.74) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6582922 0.94 PPARG (0.74) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6586240 0.93 PPARG (0.68) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6584236 0.92 PPARG (0.71) PPARGFFAR1KDRMAPTPPARA
SCHEMBL6584568 0.91 PPARG (0.68) PPARGFFAR1KDRPPARA
SCHEMBL6583835 0.90 PPARG (0.65) PPARGFFAR1KDRPPARA
SCHEMBL6052212 0.90 PPARG (0.65) PPARGFFAR1KDRPPARA

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