SCHEMBL18891722

SCHEMBL18891722

C/N=C/CCOc1ccc(Cc2cccc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC5A2 P31639 20/20 0.67
▸ SLC5A1 P13866 4/20 0.52
▸ ADRA2A P08913 1/20 0.52
▸ SLC5A11 Q8WWX8 1/20 0.52

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
SCHEMBL16351541 0.91 SLC5A2 (0.65) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL16361652 0.87 SLC5A2 (0.68) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL16672073 0.85 SLC5A2 (0.76) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL28407124 0.84 SLC5A2 (0.77) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL18891569 0.83 SLC5A2 (0.73) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL16351544 0.83 SLC5A2 (0.73) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL17623721 0.82 SLC5A2 (0.76) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL24849985 0.82 SLC5A2 (0.73) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL13513849 0.80 SLC5A2 (0.69) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL12387054 0.78 SLC5A2 (1.00) 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-2755722-B1 NOVEL SGLT INHIBITORS PANACEA BIOTEC LTD (IN) 2017-05-24 — — EP disclosed
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