SCHEMBL2162829

SCHEMBL2162829

CCOc1ccc(Cc2cc(C3OC(CSc4ccc(N)cc4)C(O)C(O)C3O)ccc2Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 19/20 0.71
SLC5A1 P13866 9/20 0.71
ADRA2A P08913 1/20 0.71
SLC5A11 Q8WWX8 1/20 0.71

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
SCHEMBL2148762 1.00 SLC5A2 (0.71) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL2149074 0.92 SLC5A2 (0.75) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL2149380 0.92 SLC5A2 (0.69) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL2154164 0.92 SLC5A2 (0.69) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL2387683 0.91 SLC5A2 (0.73) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL2148797 0.91 SLC5A2 (0.73) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL2148979 0.90 SLC5A2 (0.67) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL2148978 0.90 SLC5A2 (0.67) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL2154110 0.90 SLC5A2 (0.67) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL12252260 0.90 SLC5A2 (0.67) SLC5A2SLC5A1ADRA2ASLC5A11

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2342187-A1 GLYCOSIDE DERIVATIVES AND USES THEREOF Novartis AG (CH) 2011-07-13 EP disclosed
WO-2010031813-A1 GLYCOSIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2010-03-25 WO disclosed