SCHEMBL9435871

SCHEMBL9435871

O=C1NC(=O)C(Cc2ccc3oc(Cc4ccc5ccccc5c4)cc3c2)S1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.46
FFAR1 O14842 9/20 0.45
ALDH1A1 P00352 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 1/20 0.44
MAOA P21397 2/20 0.41
CISD1 Q9NZ45 2/20 0.41
PPARA Q07869 3/20 0.41
PTPN1 P18031 2/20 0.41
MAOB P27338 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL10514639 0.91 PPARG (0.50) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL9573697 0.91 PPARG (0.47) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL10515170 0.87 PPARG (0.48) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL9573705 0.86 PPARG (0.41) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL9573683 0.85 PPARG (0.42) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL9573694 0.85 PPARG (0.42) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL13846702 0.85 PPARG (0.59) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL9573682 0.85 PPARG (0.42) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL9573700 0.84 PPARG (0.41) PPARGFFAR1ALDH1A1NPSR1MAPT
SCHEMBL377496 0.82 FFAR1 (0.43) PPARGFFAR1ALDH1A1NPSR1MAPT

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-0559571-A1 Thiazolidine-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-09-08 EP claimed
JP-6009629-A None JP disclosed
JP-H069629-A NEW 2,4-THIAZOLIDINEDIONE COMPOUND ADIR 1994-01-18 JP disclosed
EP-0559571-A1 Thiazolidine-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-09-08 EP disclosed