SCHEMBL13670314

SCHEMBL13670314

CCc1ccc(S(=O)(=O)c2ccc(Oc3cccc4c(Oc5ccc(S(=O)(=O)c6ccc(C)cc6)cc5)cccc34)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
BCHE P06276 4/20 0.44
ACHE P22303 4/20 0.44
GAA P10253 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
MAPT P10636 4/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
F2 P00734 1/20 0.40
VDR P11473 1/20 0.40
CNR2 P34972 1/20 0.39
NR3C1 P04150 1/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 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
SCHEMBL13670309 0.95 HTT (0.57) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL822653 0.90 HTT (0.65) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL13407571 0.87 HTT (0.58) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL13670315 0.85 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL21572691 0.85 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL10030476 0.85 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL9914249 0.85 HTT (0.58) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL822840 0.84 HTT (0.70) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL13407572 0.83 HTT (0.60) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL13670327 0.81 HTT (0.61) HTTSMN1; SMN2TDP1L3MBTL1BCHE

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