SCHEMBL6969588

SCHEMBL6969588

Cc1c(C)c2c(c(C)c1OCc1ccccc1)C(CN(C)CCOc1ccc(CC3SC(=O)NC3=O)cc1)C(C)(C)O2

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.47
FFAR1 O14842 7/20 0.46
RARG P13631 1/20 0.45
RXRA P19793 1/20 0.45
PPARA Q07869 3/20 0.44
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL6966002 0.88 PPARG (0.49) PPARGFFAR1RARGRXRAPPARA
SCHEMBL6981132 0.83 RAB9A (0.39) MAPTTSHR
SCHEMBL6963373 0.83 HPGD (0.51) PPARGMEN1HPGDKMT2A
SCHEMBL6963266 0.83 HPGD (0.51) PPARGMEN1HPGDKMT2A
SCHEMBL6968430 0.83 MCHR1 (0.37) CYP1A2TSHR
SCHEMBL6968820 0.82 KCNH2 (0.44) MEN1ALDH1A1MAPTKMT2A
SCHEMBL6977206 0.81 PPARG (0.46) PPARGFFAR1RARGRXRAPPARA
SCHEMBL6976223 0.81 PPARG (0.37) PPARGPPARAMEN1ALDH1A1KMT2A
SCHEMBL6968604 0.80 PPARG (0.46) PPARGFFAR1RARGRXRAPPARA
SCHEMBL6963243 0.80 FFAR1 (0.42) PPARGFFAR1PPARAMEN1ALDH1A1

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