SCHEMBL5884072

SCHEMBL5884072

CN(CCOc1ccc(C=C2SC(=O)NC2=O)cc1)c1ccncn1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.67
PIM1 P11309 2/20 0.58
PIM2 Q9P1W9 2/20 0.58
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
PKM P14618 1/20 0.54
HTT P42858 1/20 0.54
HPGD P15428 6/20 0.54
CISD1 Q9NZ45 2/20 0.54
MAOA P21397 2/20 0.51
MAOB P27338 1/20 0.51
PTGS2 P35354 1/20 0.51

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
SCHEMBL5884071 1.00 PPARG (0.67) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL1847035 0.86 PPARG (0.78) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL2260054 0.86 PPARG (0.78) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL5111753 0.86 PPARG (0.78) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL20005828 0.85 PPARG (0.67) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL18103085 0.85 PPARG (0.67) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL1850984 0.84 PPARG (0.73) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL12520464 0.84 PPARG (0.73) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL1850981 0.84 PPARG (0.73) PPARGPIM1PIM2KDM4EALDH1A1
SCHEMBL14084491 0.82 PPARG (0.63) PPARGPIM1PIM2KDM4EALDH1A1

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-7001910-B1 Thiazolidinedione derivatives as antidiabetic agents VITA-INVEST S.A. (ES) 2006-02-21 US disclosed
EP-1231211-B1 THIAZOLIDINEDIONE DERIVATIVES AS ANTIDIABETIC AGENTS VITA INVEST SA (ES) 2003-05-28 EP disclosed
EP-1231211-A1 THIAZOLIDINEDIONE DERIVATIVES AS ANTIDIABETIC AGENTS VITA-INVEST, S.A. (ES) 2002-08-14 EP disclosed