SCHEMBL6232300

SCHEMBL6232300

COc1ccc(CC2SC(=O)NC2=O)cc1C(=O)NCc1ccc(Cl)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.49
ALDH1A1 P00352 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PPARA Q07869 2/20 0.46
CA2 P00918 1/20 0.46
ROCK2 O75116 1/20 0.45
ROCK1 Q13464 1/20 0.45
LMNA P02545 4/20 0.45
MAPK1 P28482 1/20 0.44
NLRP1 Q9C000 1/20 0.44
FFAR1 O14842 1/20 0.44
DNMT3A Q9Y6K1 1/20 0.44
TSHR P16473 1/20 0.44
RECQL P46063 1/20 0.44
HPGD P15428 2/20 0.43
PPARG P37231 1/20 0.43
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL6231739 0.90 PPARA (0.55) PTPN1ALDH1A1NPSR1PPARACA2
SCHEMBL8981831 0.88 LMNA (0.52) PTPN1ALDH1A1NPSR1PPARALMNA
SCHEMBL8981839 0.88 LMNA (0.52) PTPN1ALDH1A1NPSR1PPARALMNA
SCHEMBL8981845 0.88 LMNA (0.52) PTPN1ALDH1A1NPSR1PPARALMNA
SCHEMBL13524845 0.84 PTPN1 (0.55) PTPN1ALDH1A1NPSR1PPARACA2
SCHEMBL13847876 0.83 PTPN1 (0.54) PTPN1ALDH1A1NPSR1PPARACA2
SCHEMBL8981902 0.82 DNMT3A (0.64) DNMT3AHDAC1HDAC6
SCHEMBL8981741 0.81 LMNA (0.49) PTPN1ALDH1A1NPSR1CA2LMNA
SCHEMBL8981731 0.81 LMNA (0.49) PTPN1ALDH1A1NPSR1CA2LMNA
SCHEMBL8981737 0.81 LMNA (0.49) PTPN1ALDH1A1NPSR1CA2LMNA

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