SCHEMBL6265437

SCHEMBL6265437

COC(=O)C(OC(=O)COc1ccc(SCc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1)Oc1ccc(SCc2oc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1C

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 19/20 0.58
PPARA Q07869 12/20 0.58
PPARG P37231 7/20 0.56
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
FFAR1 O14842 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
SCHEMBL6265434 0.87 PPARD (0.71) PPARDPPARAPPARGMEN1ALDH1A1
Gw501516 SCHEMBL21391885 0.87 PPARD (0.71) PPARDPPARAPPARGMEN1ALDH1A1
SCHEMBL6237599 0.78 PPARD (0.82) PPARDPPARAPPARGMAPTFFAR1
SCHEMBL3809841 0.78 PPARD (0.65) PPARDPPARAPPARGMEN1ALDH1A1
SCHEMBL6265968 0.78 PPARD (0.60) PPARDPPARAPPARGMEN1ALDH1A1
SCHEMBL6235983 0.78 PPARD (0.83) PPARDPPARAPPARG
SCHEMBL6239544 0.78 PPARD (0.83) PPARDPPARAPPARGMEN1ALDH1A1
SCHEMBL12431568 0.76 PPARD (0.64) PPARDPPARAPPARGMEN1ALDH1A1
SCHEMBL6265961 0.76 PPARD (0.70) PPARDPPARAPPARGMEN1ALDH1A1
SCHEMBL13647570 0.76 PPARD (0.82) PPARDPPARAPPARGMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189895-B8 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM CORP (US) 2005-11-09 EP claimed
EP-1189895-A1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE GLAXO GROUP LIMITED (GB) 2002-03-27 EP claimed
WO-2001000603-A1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE GLAXO GROUP LIMITED (GB) 2001-01-04 WO claimed
EP-1189895-B8 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM CORP (US) 2005-11-09 EP disclosed
EP-1324773-A2 USE OF A PPAR DELTA ACTIVATOR IN THE TREATMENT OF DISEASES RELATED TO NO INHIBITION OR TNF INHIBITION GLAXO GROUP LIMITED (GB) 2003-07-09 EP disclosed
EP-1324774-A2 USE OF A PPAR DELTA ACTIVATOR FOR TREATING INFLAMMATORY CONDITIONS GLAXO GROUP LIMITED (GB) 2003-07-09 EP disclosed
WO-2002028434-A2 USE OF A PPAR DELTA ACTIVATOR FOR TREATING INFLAMMATORY CONDITIONS GLAXO GROUP LIMITED (GB) 2002-04-11 WO disclosed
WO-2002028433-A2 USE OF A PPAR DELTA ACTIVATOR IN THE TREATMENT OF DISEASES RELATED TO NO INHIBIT ION OR TNF INHIBITION GLAXO GROUP LIMITED (GB) 2002-04-11 WO disclosed
EP-1189895-A1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE GLAXO GROUP LIMITED (GB) 2002-03-27 EP disclosed
WO-2001000603-A1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE GLAXO GROUP LIMITED (GB) 2001-01-04 WO disclosed