SCHEMBL12769552

SCHEMBL12769552

Cc1ccc(S(=O)(=O)c2ccc(Oc3ccc4cc(C)ccc4c3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.73
L3MBTL1 Q9Y468 2/20 0.73
TDP1 Q9NUW8 1/20 0.73
SMN1; SMN2 Q16637 3/20 0.67
GAA P10253 1/20 0.55
ALDH1A1 P00352 4/20 0.48
CYP2C9 P11712 3/20 0.48
CYP2C19 P33261 2/20 0.48
CYP3A4 P08684 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PKM P14618 1/20 0.46
FFAR1 O14842 1/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2A6 P11509 1/20 0.45
RAPGEF4 Q8WZA2 2/20 0.44
POLB P06746 1/20 0.44
APEX1 P27695 1/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL12769546 0.97 HTT (0.69) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL822869 0.96 HTT (0.73) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL822868 0.93 HTT (0.69) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL12198432 0.92 HTT (0.63) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL14498086 0.90 HTT (0.65) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL9914248 0.90 HTT (0.65) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL8766848 0.90 HTT (0.61) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL10034462 0.87 HTT (0.61) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL2606163 0.87 HTT (0.85) HTTL3MBTL1TDP1SMN1; SMN2GAA
SCHEMBL822843 0.87 HTT (0.85) HTTL3MBTL1TDP1SMN1; SMN2GAA

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-7910248-B2 Aromatic-polyether-type ion-conductive ultrahigh molecular weight polymer, intermediate therefor, and process for producing these SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-22 US disclosed
US-7910248-B2 Aromatic-polyether-type ion-conductive ultrahigh molecular weight polymer, intermediate therefor, and process for producing these SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-22 US disclosed