SCHEMBL10016733

SCHEMBL10016733

Cc1ccc(S(=O)(=O)c2ccc(S(=O)(=O)c3ccc(Oc4ccc(S(C)(=O)=O)cc4)cc3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 5/20 0.73
▸ SMN1; SMN2 Q16637 3/20 0.73
▸ TDP1 Q9NUW8 1/20 0.65
▸ L3MBTL1 Q9Y468 1/20 0.65
▸ GAA P10253 1/20 0.61
▸ PTGS2 P35354 6/20 0.51
▸ PTGS1 P23219 2/20 0.50
▸ PKM P14618 1/20 0.50
▸ FFAR1 O14842 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ LMNA P02545 2/20 0.46
▸ TEAD4 Q15561 1/20 0.45

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
SCHEMBL23153426 1.00 HTT (0.73) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL19105488 1.00 HTT (0.73) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL10014119 0.95 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL9888806 0.95 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL15097133 0.95 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL13814624 0.94 HTT (0.63) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL2758531 0.94 HTT (0.63) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL822843 0.92 HTT (0.85) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL2606163 0.92 HTT (0.85) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL12268296 0.92 HTT (0.85) HTTSMN1; SMN2TDP1L3MBTL1GAA

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-20120165467-A1 NEW POLYELECTROLYTE COMPLEXES AND THE USE THEREOF HERAEUS PRECIOUS METALS GMBH & CO. KG 2012-06-28 — — US disclosed
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