Olsalazine

Olsalazine

SCHEMBL4096909

Nc1ccc(O)c(C(=O)O)c1.O=C([O-])c1cc(/N=N/c2ccc(O)c(C(=O)[O-])c2)ccc1O.[Na+].[Na+]

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ALOX5PPARGPTGS1PTGS2

The experimentally established mechanism targets of Olsalazine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 known ✓ P35354 2/20 0.63
PTGS1 known ✓ P23219 1/20 0.59
MEN1 O00255 5/20 0.66
KMT2A Q03164 5/20 0.66
KDR P35968 2/20 0.66
BLVRB P30043 2/20 0.66
PDE4A P27815 1/20 0.66
HTT P42858 1/20 0.66
TDP1 Q9NUW8 6/20 0.63
ALDH1A1 P00352 5/20 0.63
CYP2C9 P11712 3/20 0.63
HSD17B10 Q99714 3/20 0.63
KDM4E B2RXH2 3/20 0.63
THRB P10828 3/20 0.63
RECQL P46063 3/20 0.63
CYP2C19 P33261 3/20 0.63
HPGD P15428 3/20 0.63
CYP3A4 P08684 2/20 0.63
CASP1 P29466 2/20 0.63
HIF1A Q16665 2/20 0.63

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
Olsalazine SCHEMBL15201080 0.91 MEN1 (0.79) MEN1KMT2AKDRBLVRBPDE4A
Olsalazine SCHEMBL8703147 0.91 MEN1 (0.79) MEN1KMT2AKDRBLVRBPDE4A
Olsalazine SCHEMBL1830807 0.91 MEN1 (0.79) MEN1KMT2AKDRBLVRBPDE4A
SCHEMBL1614891 0.88 TDP1 (0.57) MEN1KMT2AKDRBLVRBPDE4A
Olsalazine SCHEMBL28241744 0.85 TDP1 (0.54) MEN1KMT2AKDRBLVRBPDE4A
SCHEMBL4326140 0.85 MEN1 (0.79) MEN1KMT2AKDRBLVRBPDE4A
SCHEMBL4326144 0.85 MEN1 (0.79) MEN1KMT2AKDRBLVRBPDE4A
Olsalazine SCHEMBL29767 0.84 MEN1 (0.66) MEN1KMT2AKDRBLVRBPDE4A
Olsalazine SCHEMBL3476110 0.84 MEN1 (0.66) MEN1KMT2AKDRBLVRBPDE4A
Olsalazine SCHEMBL29454399 0.84 MEN1 (0.66) MEN1KMT2AKDRBLVRBPDE4A

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-20090023805-A1 METHOD OF ADMINISTRATION MARRAST ANNE CLAIRE 2009-01-22 US disclosed
EP-1933835-A1 PHARMACEUTICALLY ACTIVE TETRAHYDRO-PYRROLO[1,2-B]ISOTHIAZOLE 1,1-DIOXIDES Novartis AG (CH) 2008-06-25 EP disclosed
WO-2007039616-A1 PHARMACEUTICALLY ACTIVE TETRAHYDRO-PYRROLO[1,2-B]ISOTHIAZOLE 1,1-DIOXIDES NOVARTIS AG (CH) 2007-04-12 WO disclosed