SCHEMBL14302392

SCHEMBL14302392

COc1ccc(Cc2cccc([C@@H]3O[C@H](CC#N)[C@@H](O)[C@H](O)C3O)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SLC5A2 P31639 20/20 0.57
▸ SLC5A1 P13866 5/20 0.53

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
SCHEMBL14108371 1.00 SLC5A2 (0.57) SLC5A2SLC5A1
SCHEMBL14108378 0.89 SLC5A2 (0.57) SLC5A2SLC5A1
SCHEMBL14108320 0.83 SLC5A2 (0.78) SLC5A2SLC5A1
SCHEMBL28717576 0.81 SLC5A2 (0.81) SLC5A2SLC5A1
SCHEMBL12782031 0.79 SLC5A2 (0.61) SLC5A2SLC5A1
SCHEMBL23818232 0.79 SLC5A2 (0.60) SLC5A2SLC5A1
SCHEMBL14108350 0.78 SLC5A2 (0.57) SLC5A2SLC5A1
SCHEMBL14108374 0.78 SLC5A2 (0.57) SLC5A2SLC5A1
SCHEMBL28407124 0.76 SLC5A2 (0.77) SLC5A2SLC5A1
SCHEMBL28712344 0.75 SLC5A2 (0.73) SLC5A2SLC5A1

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
EP-1765842-B1 D-XYLOPYRANOSYL-SUBSTITUTED PHENYLS, MEDICAMENTS CONTAINING SAID COMPOUNDS, THE USE THEREOF, AND METHODS FOR PRODUCING THE SAME BOEHRINGER INGELHEIM INT (DE) 2008-01-09 — — EP disclosed
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