SCHEMBL5833434

SCHEMBL5833434

CCCCCCCCCCCCS(=O)(=O)O.CCCCCCCCCCCCS(=O)(=O)O.[NaH].[Na]c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.41
S1PR2 O95136 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
EPHX2 P34913 1/20 0.41
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
MMP13 P45452 1/20 0.41
EPHX1 P07099 3/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 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
SCHEMBL27895510 0.98 NAAA (0.42) NAAAS1PR2S1PR1S1PR3EPHX2
Toluene SCHEMBL29170928 0.85 NAAA (0.42) NAAAS1PR2S1PR1S1PR3EPHX2
Biphenyl SCHEMBL27876466 0.84 PTPN1 (0.48) NAAAS1PR2S1PR1S1PR3EPHX2
Benzene SCHEMBL27649746 0.84 EPHX2 (0.51) S1PR2S1PR1S1PR3EPHX2ALDH1A1
Benzene SCHEMBL28758814 0.84 EPHX2 (0.51) S1PR2S1PR1S1PR3EPHX2ALDH1A1
Benzene SCHEMBL11150225 0.84 EPHX2 (0.51) S1PR2S1PR1S1PR3EPHX2ALDH1A1
Benzene SCHEMBL27649739 0.84 EPHX2 (0.51) S1PR2S1PR1S1PR3EPHX2ALDH1A1
Benzene SCHEMBL112147 0.84 EPHX2 (0.51) S1PR2S1PR1S1PR3EPHX2ALDH1A1
O-Xylene SCHEMBL28909383 0.83 S1PR2 (0.43) NAAAS1PR2S1PR1S1PR3EPHX2
Biphenyl SCHEMBL6253922 0.83 PTPN1 (0.47) NAAAS1PR2S1PR1S1PR3EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7041754-B2 Emulsion type modifier for improving properties of pressure sensitive emulsion acrylic adhesives CHIEF INVESTMENT CORP. (TW) 2006-05-09 US claimed
US-20050250887-A1 Emulsion type acrylic pressure sensitive adhesives CHIEF INVESTMENT CORP. (TW) 2005-11-10 US claimed
US-20040192820-A1 Emulsion type modifier for improving properties of pressure sensitive emulsion acrylic adhesives CHIEF INVESTMENT CORP. (TW) 2004-09-30 US claimed
US-7041754-B2 Emulsion type modifier for improving properties of pressure sensitive emulsion acrylic adhesives CHIEF INVESTMENT CORP. (TW) 2006-05-09 US disclosed
US-20050250887-A1 Emulsion type acrylic pressure sensitive adhesives CHIEF INVESTMENT CORP. (TW) 2005-11-10 US disclosed
US-20040192820-A1 Emulsion type modifier for improving properties of pressure sensitive emulsion acrylic adhesives CHIEF INVESTMENT CORP. (TW) 2004-09-30 US disclosed