SCHEMBL13670326

SCHEMBL13670326

CCc1ccc(S(=O)(=O)c2ccc(Oc3ccc(C4(c5ccc(Oc6ccc(S(=O)(=O)c7ccc(C)cc7)cc6)cc5)c5ccccc5-c5ccccc54)cc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
F2 P00734 1/20 0.41
VDR P11473 1/20 0.41
NR3C1 P04150 1/20 0.40
BCHE P06276 3/20 0.39
ACHE P22303 3/20 0.39
FFAR1 O14842 1/20 0.39
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38
CNR2 P34972 1/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.35
OPRK1 P41145 1/20 0.35

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
SCHEMBL822949 0.92 HTT (0.63) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL16352320 0.90 SMN1; SMN2 (0.44) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL13557150 0.90 HTT (0.56) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL9914257 0.87 HTT (0.57) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL13321958 0.87 HTT (0.57) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL12341727 0.87 HTT (0.57) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL13670323 0.84 MAPK14 (0.44) HTTSMN1; SMN2ALDH1A1MAPTACHE
SCHEMBL17808969 0.84 HTT (0.53) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL17207929 0.83 SMN1; SMN2 (0.51) HTTSMN1; SMN2TDP1L3MBTL1ALDH1A1
SCHEMBL13266250 0.83 HTT (0.47) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090269645-A1 POLYMER, POLYMER ELECTROLYTE AND FUEL CELL USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-29 US disclosed