SCHEMBL4412908

SCHEMBL4412908

CCOc1ccc(Cn2nnc3cccc(O[C@@]4(O)[C@H](O)O[C@@H](CO)[C@H](O)[C@H]4O)c32)cc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC5A2 P31639 20/20 0.48
▸ SLC5A1 P13866 7/20 0.39
▸ ADRA2A P08913 1/20 0.37
▸ SLC5A11 Q8WWX8 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
SCHEMBL4336925 1.00 SLC5A2 (0.48) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL4336931 1.00 SLC5A2 (0.48) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL4412899 1.00 SLC5A2 (0.48) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL3411512 0.91 SLC5A2 (0.47) SLC5A2SLC5A1
SCHEMBL4422405 0.91 SLC5A2 (0.47) SLC5A2SLC5A1
SCHEMBL3413369 0.91 SLC5A2 (0.47) SLC5A2SLC5A1
SCHEMBL3411517 0.91 SLC5A2 (0.47) SLC5A2SLC5A1
SCHEMBL4414328 0.85 SLC5A2 (0.40) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL4332319 0.85 SLC5A2 (0.40) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL4414321 0.85 SLC5A2 (0.40) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1679966-A4 SUBSTITUTED BENZIMIDAZOLE-, BENZTRIAZOLE-, AND BENZIMIDAZOLONE-O-GLUCOSIDES JANSSEN PHARMACEUTICA NV (BE) 2009-05-27 — — EP claimed
EP-1679966-A2 SUBSTITUTED BENZIMIDAZOLE-, BENZTRIAZOLE-, AND BENZIMIDAZOLONE-O-GLUCOSIDES JANSSEN PHARMACEUTICA N.V. (BE) 2006-07-19 — — EP claimed
WO-2005012242-A2 SUBSTITUTED BENZIMIDAZOLE-, BENZTRIAZOLE-, AND BENZIMIDAZOLONE-O-GLUCOSIDES JANSSEN PHARMACEUTICA NV (BE) 2005-02-10 — — WO claimed
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