SCHEMBL7987769

SCHEMBL7987769

CS(=O)(=O)Oc1ccc(CCOc2ccc(C(N)O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.57
PPARG P37231 4/20 0.57
PPARD Q03181 3/20 0.47
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
FFAR1 O14842 2/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL3113325 0.81 NPC1 (0.58) PPARAPPARGPPARDCA12CA1
SCHEMBL12442802 0.80 PPARA (0.57) PPARAPPARGPPARDCA12CA1
SCHEMBL13156122 0.80 PPARA (0.57) PPARAPPARGPPARDCA12CA1
SCHEMBL7987736 0.80 PPARA (0.58) PPARAPPARGPPARDCA12CA1
SCHEMBL13889531 0.79 PPARA (0.71) PPARAPPARGPPARDCA12CA1
SCHEMBL14376420 0.79 PPARA (0.64) PPARAPPARGPPARDCA12CA1
SCHEMBL7155846 0.78 FFAR1 (0.68) PPARAPPARGPPARDFFAR1LMNA
SCHEMBL7987719 0.78 PPARA (0.59) PPARAPPARGPPARDFFAR1L3MBTL1
SCHEMBL7987772 0.78 PPARA (0.56) PPARAPPARGPPARDCA12CA1
SCHEMBL7620234 0.78 PPARA (0.62) PPARAPPARGPPARDFFAR1LMNA

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
US-6288096-B1 ANTIDIABETIC AGENTS, HYPOTENSIVE AGENTS, AND ANTICHOLESTEROL AGENTS ASTRAZENECA AB (SE) 2001-09-11 US disclosed
EP-0991632-A1 NEW THIAZOLIDINEDIONE, OXAZOLIDINEDIONE AND OXADIAZOLIDINEDIONE DERIVATIVES Astra Aktiebolag (SE) 2000-04-12 EP disclosed
WO-1998057941-A1 NEW THIAZOLIDINEDIONE, OXAZOLIDINEDIONE AND OXADIAZOLIDINEDIONE DERIVATIVES ASTRA AKTIEBOLAG (SE) 1998-12-23 WO disclosed