SCHEMBL13670334

SCHEMBL13670334

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
BCHE P06276 4/20 0.47
ACHE P22303 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HSD11B1 P28845 2/20 0.42
GAA P10253 1/20 0.41
ALDH1A1 P00352 4/20 0.38
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
NR3C1 P04150 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL822939 0.91 HTT (0.61) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL14365486 0.91 HTT (0.61) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL10030390 0.89 HTR2A (0.40) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL13407565 0.86 HTT (0.58) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL13670315 0.86 HTT (0.67) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL21572691 0.86 HTT (0.67) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL10030476 0.86 HTT (0.67) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL9914256 0.85 HSD11B1 (0.58) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL13670317 0.85 HTT (0.55) HTTSMN1; SMN2BCHEACHETDP1
SCHEMBL12198430 0.85 HSD11B1 (0.58) HTTSMN1; SMN2BCHEACHETDP1

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