SCHEMBL6966002

SCHEMBL6966002

Cc1c(C)c2c(c(C)c1O)C(CN(C)CCOc1ccc(CC3SC(=O)NC3=O)cc1)C(C)(C)O2

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.49
CYP3A4 P08684 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PPARA Q07869 3/20 0.46
RXRA P19793 2/20 0.44
RARG P13631 1/20 0.44
FFAR1 O14842 3/20 0.43
HRH3 Q9Y5N1 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
SCHEMBL6969588 0.88 PPARG (0.47) PPARGCYP3A4MEN1ALDH1A1TP53
SCHEMBL6976890 0.81 PIM1 (0.47) PPARGHPGD
SCHEMBL6975119 0.81 PIM1 (0.47) PPARGHPGD
SCHEMBL6974817 0.79 MEN1 (0.50) PPARGCYP3A4MEN1ALDH1A1TP53
SCHEMBL6967584 0.78 MEN1 (0.49) PPARGCYP3A4MEN1ALDH1A1TP53
SCHEMBL6976385 0.77 CYP3A4 (0.46) PPARGCYP3A4MEN1ALDH1A1TP53
SCHEMBL6964327 0.77 CYP3A4 (0.46) PPARGCYP3A4MEN1ALDH1A1TP53
SCHEMBL6964333 0.77 CYP3A4 (0.46) PPARGCYP3A4MEN1ALDH1A1TP53
SCHEMBL9632215 0.77 MAPT (0.53) PPARGCYP3A4MEN1ALDH1A1TP53
Hydrochloric Acid SCHEMBL6977644 0.76 CYP3A4 (0.45) PPARGCYP3A4MEN1ALDH1A1TP53

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-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 claimed
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