SCHEMBL7987761

SCHEMBL7987761

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
MAPT P10636 2/20 0.55
HPGD P15428 2/20 0.55
LMNA P02545 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PPARA Q07869 5/20 0.54
PPARG P37231 4/20 0.54
STS P08842 1/20 0.46
PPARD Q03181 2/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
RAB9A P51151 1/20 0.41
FFAR1 O14842 1/20 0.40
CYP2A6 P11509 1/20 0.40
CACNA1F O60840 1/20 0.39
CHRM2 P08172 1/20 0.39
ACHE P22303 1/20 0.39

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
SCHEMBL7996910 0.85 ALDH1A1 (0.55) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL7996977 0.85 ALDH1A1 (0.46) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL7208039 0.85 PPARA (0.45) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL7208044 0.85 ALDH1A1 (0.44) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL7987746 0.85 ALDH1A1 (0.51) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL7987738 0.83 MEN1 (0.55) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL13156122 0.83 PPARA (0.57) PPARAPPARGPPARDCA12CA1
SCHEMBL12442802 0.83 PPARA (0.57) PPARAPPARGPPARDCA12CA1
SCHEMBL7987766 0.83 HPGD (0.49) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL3664105 0.82 STS (0.64) ALDH1A1MAPTHPGDLMNASMN1; SMN2

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