SCHEMBL13670317

SCHEMBL13670317

CCc1ccc(S(=O)(=O)c2ccc(Oc3ccc(C(C)(C)c4ccc(Oc5ccc(S(=O)(=O)c6ccc(C)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
BCHE P06276 4/20 0.45
ACHE P22303 4/20 0.45
GAA P10253 1/20 0.44
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NR3C1 P04150 1/20 0.40
CA2 P00918 1/20 0.39
FFAR1 O14842 1/20 0.39
HSD11B1 P28845 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 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
SCHEMBL14477641 1.00 HTT (0.55) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL822855 0.90 HTT (0.56) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL13670315 0.90 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL21572691 0.90 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL12769543 0.90 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL822791 0.90 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL10030476 0.90 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1BCHE
SCHEMBL24968065 0.89 PKM (0.53) HTTSMN1; SMN2BCHEACHEGAA
SCHEMBL10030393 0.88 TEAD4 (0.42) HTTSMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL12755539 0.88 HTT (0.40) 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