SCHEMBL10034487

SCHEMBL10034487

CCOc1ccc(-c2ccc(Oc3ccc(S(=O)(=O)c4ccc(C)cc4)cc3)c(-c3ccccc3)c2)cc1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ HTT P42858 2/20 0.52
▸ TDP1 Q9NUW8 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ PTGS2 P35354 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ PTGDR2 Q9Y5Y4 2/20 0.43
▸ CNR2 P34972 1/20 0.41
▸ PTPRC P08575 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ SLC6A9 P48067 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.38

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
SCHEMBL822849 0.92 HTT (0.61) SMN1; SMN2HTTTDP1L3MBTL1PTGS2
SCHEMBL13670320 0.89 HTT (0.52) SMN1; SMN2HTTTDP1L3MBTL1PTGS2
SCHEMBL10018170 0.87 HTT (0.56) SMN1; SMN2HTTTDP1L3MBTL1PTGS2
SCHEMBL13665720 0.86 HTT (0.52) SMN1; SMN2HTTTDP1L3MBTL1PTGS2
SCHEMBL10018168 0.86 HTT (0.58) SMN1; SMN2HTTTDP1L3MBTL1PTGS2
SCHEMBL13407547 0.84 KEAP1 (0.47) SMN1; SMN2HTTALDH1A1MAPT
SCHEMBL13668496 0.83 SMN1; SMN2 (0.46) SMN1; SMN2HTTTDP1L3MBTL1PTGS2
SCHEMBL10018169 0.81 HTT (0.52) SMN1; SMN2HTTTDP1L3MBTL1PTGS2
SCHEMBL13266193 0.80 HTT (0.43) SMN1; SMN2HTTTDP1L3MBTL1PTGS2
SCHEMBL10034457 0.79 HTT (0.61) SMN1; SMN2HTTTDP1L3MBTL1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178590-B2 Block copolymer and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-15 — — US disclosed
US-20070281195-A1 Block copolymer and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED 2007-12-06 — — US disclosed
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