SCHEMBL6231739

SCHEMBL6231739

COc1ccc(CC2SC(=O)NC2=O)cc1C(=O)NCc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.55
PTPN1 P18031 2/20 0.53
PPARG P37231 2/20 0.49
ALDH1A1 P00352 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
LMNA P02545 3/20 0.47
HPGD P15428 2/20 0.47
DNMT3A Q9Y6K1 1/20 0.45
CA2 P00918 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL8981831 0.94 LMNA (0.52) PPARAPTPN1PPARGALDH1A1NPSR1
SCHEMBL8981845 0.94 LMNA (0.52) PPARAPTPN1PPARGALDH1A1NPSR1
SCHEMBL8981839 0.94 LMNA (0.52) PPARAPTPN1PPARGALDH1A1NPSR1
SCHEMBL13524845 0.92 PTPN1 (0.55) PPARAPTPN1PPARGALDH1A1NPSR1
SCHEMBL13847876 0.91 PTPN1 (0.54) PPARAPTPN1PPARGALDH1A1NPSR1
SCHEMBL6232300 0.90 PTPN1 (0.49) PPARAPTPN1PPARGALDH1A1NPSR1
SCHEMBL6376424 0.89 POLB (0.54) PPARAPTPN1PPARGALDH1A1LMNA
SCHEMBL6374920 0.88 PPARA (0.57) PPARAPTPN1PPARGALDH1A1LMNA
SCHEMBL3922 0.87 PPARA (0.61) PPARAPTPN1PPARG
SCHEMBL6233615 0.87 PTPN1 (0.51) PPARAPTPN1PPARGCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1207158-B1 SUBSTITUTED BENZYLTHIAZOLIDINE-2,4-DIONE DERIVATIVES KYORIN SEIYAKU KK (JP) 2005-05-25 EP claimed
US-6780431-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR AGONISTS; METABOLIC DISEASES SUCH AS DIABETES AND HYPERLIPIDEMIA KYORIN PHARMACEUTICAL CO., LTD. (JP) 2004-08-24 US claimed
EP-1207158-A1 SUBSTITUTED BENZYLTHIAZOLIDINE-2,4-DIONE DERIVATIVES KYORIN PHARMACEUTICAL CO., LTD. (JP) 2002-05-22 EP claimed