SCHEMBL13670307

SCHEMBL13670307

CCc1ccc(S(=O)(=O)c2ccc(Oc3ccc4cc(Oc5ccc(S(=O)(=O)c6ccc(C)cc6)cc5)ccc4c3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.60
TDP1 Q9NUW8 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
SMN1; SMN2 Q16637 3/20 0.58
GAA P10253 1/20 0.47
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
POLB P06746 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NR3C1 P04150 1/20 0.41
CA2 P00918 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
LMNA P02545 1/20 0.41
FFAR1 O14842 1/20 0.40

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
SCHEMBL13670328 0.97 HTT (0.57) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL21572691 0.92 HTT (0.67) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL13670315 0.92 HTT (0.67) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL10030476 0.92 HTT (0.67) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL822869 0.89 HTT (0.73) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL13670327 0.88 HTT (0.61) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL14346196 0.88 HTT (0.61) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL13581355 0.88 HTT (0.61) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL12769552 0.86 HTT (0.73) HTTTDP1L3MBTL1SMN1; SMN2GAA
SCHEMBL822868 0.86 HTT (0.69) HTTTDP1L3MBTL1SMN1; 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 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