SCHEMBL14081900

SCHEMBL14081900

CCOC1CCC(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)CC1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 20/20 0.61
SLC5A1 P13866 10/20 0.61
ADRA2A P08913 1/20 0.59
SLC5A11 Q8WWX8 1/20 0.59

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
SCHEMBL4806124 0.91 SLC5A2 (0.62) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL14081890 0.89 SLC5A2 (0.63) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL14081923 0.87 SLC5A2 (0.58) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL4805622 0.85 SLC5A2 (0.64) SLC5A2SLC5A1
SCHEMBL14081928 0.84 SLC5A2 (0.55) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL4806696 0.84 SLC5A2 (0.61) SLC5A2SLC5A1
SCHEMBL4806336 0.84 SLC5A2 (0.64) SLC5A2SLC5A1
SCHEMBL14081894 0.83 SLC5A2 (0.72) SLC5A2SLC5A1
SCHEMBL14081939 0.82 SLC5A2 (0.59) SLC5A2SLC5A1
SCHEMBL5925486 0.82 SLC5A2 (0.52) 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
US-7417032-B2 D-xylopyranosyl-phenyl-substituted cycles, medicaments containing such compounds, their use and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-08-26 US disclosed
US-7417032-B2 D-xylopyranosyl-phenyl-substituted cycles, medicaments containing such compounds, their use and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-08-26 US disclosed