SCHEMBL6975853

SCHEMBL6975853

Cc1c(C)c2c(c(C)c1OCc1ccccc1)CCC(C)(CN(C)CCOc1ccc3cc(C=C4SC(=O)NC4=O)ccc3c1)O2

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.45
HPGD P15428 9/20 0.45
PTPN1 P18031 5/20 0.45
POLB P06746 1/20 0.45
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC4 P56524 1/20 0.41
HDAC8 Q9BY41 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
SCHEMBL6967873 0.94 HPGD (0.51) PPARGHPGDPTPN1POLBMAOA
SCHEMBL6967865 0.94 HPGD (0.51) PPARGHPGDPTPN1POLBMAOA
SCHEMBL6979687 0.88 HPGD (0.50) PPARGHPGDPTPN1POLBMAOA
SCHEMBL6967821 0.88 HPGD (0.50) PPARGHPGDPTPN1POLBMAOA
SCHEMBL6968992 0.87 PPARG (0.45) PPARGMEN1KMT2AHDAC4HDAC8
SCHEMBL6968997 0.87 PPARG (0.45) PPARGMEN1KMT2AHDAC4HDAC8
SCHEMBL6974450 0.86 HPGD (0.49) PPARGHPGDPTPN1POLBMAOA
SCHEMBL6974454 0.86 HPGD (0.49) PPARGHPGDPTPN1POLBMAOA
SCHEMBL7134832 0.86 KMT2A (0.41) PPARGHPGDPTPN1POLBMAOA
SCHEMBL7829571 0.82 HPGD (0.57) HPGDPTPN1POLBMAOAMAOB

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-0801063-B1 Thiazolidinedione derivatives having antidiabetic, hypolipidaemic, antihypertensive properties, process for their preparation and pharmaceutical compositions containing them REDDYS LAB LTD DR (IN) 2003-01-15 EP disclosed
EP-0801063-A1 Thiazolidinedione derivatives having antidiabetic, hypolipidaemic antihypertensive properties, process for their preparation and pharmaceutical compositions containing them DR. REDDY'S RESEARCH FOUNDATION (IN) 1997-10-15 EP disclosed