SCHEMBL12426017

SCHEMBL12426017

COc1cccc(Oc2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)c1C#N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 2/20 0.50
HSD11B1 P28845 1/20 0.47
AR P10275 4/20 0.47
MAPT P10636 2/20 0.46
TSHR P16473 1/20 0.43
PKM P14618 1/20 0.42
GAA P10253 2/20 0.42
SLC22A12 Q96S37 1/20 0.42
POLB P06746 2/20 0.41
GPR119 Q8TDV5 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM4E B2RXH2 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
SCHEMBL16520919 0.90 HTT (0.50) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL26572702 0.87 PKM (0.50) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL12425090 0.85 PKM (0.51) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL15760415 0.85 MAPT (0.53) HTTSMN1; SMN2TDP1L3MBTL1HSD11B1
SCHEMBL16520920 0.82 HSD11B1 (0.46) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL9914249 0.81 HTT (0.58) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL12426029 0.79 MAPT (0.48) HTTSMN1; SMN2TDP1L3MBTL1HSD11B1
SCHEMBL12425105 0.79 MAPT (0.42) HTTSMN1; SMN2TDP1L3MBTL1HSD11B1
SCHEMBL14264189 0.78 MAPT (0.69) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL822653 0.77 HTT (0.65) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977451-B2 polyphenylene ethers used for blood dialysis and filtration GENERAL ELECTRIC COMPANY (US) 2011-07-12 US disclosed
US-7695628-B2 hollow fiber modules comprising blends of polyphenylene ethers block polymers and polyvinylpyrrolidone, used for blood dialysis and filtration GENERAL ELECTRIC COMPANY (US) 2010-04-13 US disclosed
US-20080142443-A1 POLYARYLETHER MEMBRANES GENERAL ELECTRIC (US) 2008-06-19 US disclosed
US-20080142442-A1 hollow fiber modules comprising blends of polyphenylene ethers block polymers and polyvinylpyrrolidone, used for blood dialysis and filtration GENERAL ELECTRIC (US) 2008-06-19 US disclosed