SCHEMBL751336

SCHEMBL751336

O=C(O)c1ccc(S(=O)(=O)O)c(-c2ccccc2)c1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
MMP1 P03956 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP13 P45452 1/20 0.41
CYP2D6 P10635 1/20 0.39
HNF4A P41235 2/20 0.39
CDC25B P30305 1/20 0.39
ATM Q13315 1/20 0.39
ACMSD Q8TDX5 1/20 0.39
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 1/20 0.38
LMNA P02545 1/20 0.37
ACLY P53396 3/20 0.37
KDM4E B2RXH2 2/20 0.37
TSHR P16473 3/20 0.36
HSD17B10 Q99714 2/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL27569188 0.89 BCAT2 (0.41) CA1CA2MMP1MMP2MMP9
SCHEMBL751983 0.84 CYP2D6 (0.52) CA1CA2CYP2D6CDC25BACMSD
SCHEMBL6338048 0.84 TSHR (0.45) CA1CA2MMP1MMP2MMP9
SCHEMBL28190235 0.82 CYP2D6 (0.41) CA1CA2MMP1MMP2MMP9
SCHEMBL27569192 0.81 BCAT2 (0.42) CA1CA2ALDH1A1KDM4ETSHR
SCHEMBL30395913 0.80 WDR5 (0.48) CA1CA2HNF4ACDC25BATM
SCHEMBL6755748 0.80 WDR5 (0.48) CA1CA2HNF4ACDC25BATM
SCHEMBL11286862 0.79 CA1 (0.51) CA1CA2MMP1MMP2MMP9
SCHEMBL27534240 0.79 ALDH1A1 (0.43) CA1CA2MMP1MMP2MMP9
SCHEMBL4976544 0.79 CYP2D6 (0.41) CA1CA2MMP1MMP2MMP9

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110095109-A1 Process for Producing Polyester Pellets CLARIANT FINANCE (BVI) LIMITED (VG) 2011-04-28 US claimed
EP-2552994-B1 COLORED POLYESTER CLARIANT FINANCE BVI LTD (VG) 2015-02-18 EP disclosed
US-20130045912-A1 Colored Polyester CLARIANT FINANCE (BVI) LIMITED (VG) 2013-02-21 US disclosed
EP-2552994-A1 COLORED POLYESTER Clariant Finance (BVI) Limited (VG) 2013-02-06 EP disclosed
EP-2431456-A1 New amphiphile polycondensates and use of same in combination with polyester or surfaces containing polyester Polyprec GmbH (DE) 2012-03-21 EP disclosed
WO-2011120653-A1 COLORED POLYESTER CLARIANT INTERNATIONAL LTD (CH) 2011-10-06 WO disclosed
US-20110095109-A1 Process for Producing Polyester Pellets CLARIANT FINANCE (BVI) LIMITED (VG) 2011-04-28 US disclosed
EP-2291428-A1 PROCESS FOR PRODUCING POLYESTER PELLETS Clariant Finance (BVI) Limited (VG) 2011-03-09 EP disclosed
WO-2009152994-A1 PROCESS FOR PRODUCING POLYESTER PELLETS CLARIANT INTERNATIONAL LTD (CH) 2009-12-23 WO disclosed
EP-1161516-B1 SULPHONATED COPOLYMER AND METHOD FOR CLEANING SURFACES AND/OR PROVIDING SAME WITH STAIN RESISTANT PROPERTIES AND/OR FOR FACILITATING STAIN AND SOIL RELEASE RHODIA CHIMIE SA (FR) 2005-08-24 EP disclosed
EP-1161516-A1 SULPHONATED COPOLYMER AND METHOD FOR CLEANING SURFACES AND/OR PROVIDING SAME WITH STAIN RESISTANT PROPERTIES AND/OR FOR FACILITATING STAIN AND SOIL RELEASE Rhodia Chimie (FR) 2001-12-12 EP disclosed
US-6300306-B1 TREATING HARD SURFACES, POLYOXYALKYLENE UNITS AND SULFONATEDPOLYAMIDES AND SULFONATED POLYFUNCTIONAL UNITS AND BINDING GROUPS WITH ESTER RHODIA CHIMIE (FR) 2001-10-09 US disclosed
WO-2000053711-A1 SULPHONATED COPOLYMER AND METHOD FOR CLEANING SURFACES AND/OR PROVIDING SAME WITH STAIN RESISTANT PROPERTIES AND/OR FOR FACILITATING STAIN AND SOIL RELEASE RHODIA CHIMIE (FR) 2000-09-14 WO disclosed