SCHEMBL8461580

SCHEMBL8461580

O=C1NC(=O)C(Cc2ccc3c(c2)CC(Cc2ccccc2)S3)S1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.54
▸ FFAR1 O14842 6/20 0.50
▸ MAPT P10636 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MAOB P27338 2/20 0.47
▸ CA2 P00918 1/20 0.47
▸ PPARA Q07869 2/20 0.46
▸ PTPN1 P18031 1/20 0.45
▸ MAOA P21397 2/20 0.44
▸ CISD1 Q9NZ45 2/20 0.44
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL10683704 0.81 PPARG (0.56) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL10368995 0.81 ALDH1A1 (0.54) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL166570 0.79 PPARG (0.74) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL10689114 0.78 PPARG (0.53) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL10686384 0.77 PPARG (0.52) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL10686431 0.77 PPARG (0.52) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL6903859 0.77 PPARG (0.52) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL10690190 0.77 PPARG (0.52) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL6866703 0.77 PPARG (0.71) PPARGFFAR1MAPTALDH1A1NPSR1
SCHEMBL8460436 0.76 PPARG (0.51) PPARGFFAR1MAPTALDH1A1NPSR1

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
WO-1999059586-A1 THIAZOLIDINE AND OXAZOLIDINE DERIVATIVES FOR THE TREATMENT OF ACUTE MYOCARDIAL INFARCTION AND INHIBITION OF CARDIOMYOCYTE APOPTOSIS REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-11-25 — — WO claimed
EP-0207605-B1 HYPOGLYCEMIC THIAZOLIDINEDIONES PFIZER INC. (US) 1990-02-07 — — EP disclosed
WO-1986007056-A1 HYPOGLYCEMIC THIAZOLIDINEDIONES PFIZER INC. (US) 1986-12-04 — — WO disclosed
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