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Sugi Predict / Compounds / SCHEMBL13764503

SCHEMBL13764503

SCHEMBL13764503

CC(C)(NC(=O)CCCc1ccc(CCc2coc3cccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c23)cc1)C(=O)N1CCNCC1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 20/20 0.60
▸ SLC5A2 P31639 19/20 0.60

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
SCHEMBL1728276 0.96 SLC5A1 (0.55) SLC5A1SLC5A2
SCHEMBL13764502 0.91 SLC5A1 (0.51) SLC5A1SLC5A2
SCHEMBL13764500 0.90 SLC5A1 (0.48) SLC5A1SLC5A2
SCHEMBL1728281 0.87 SLC5A1 (0.49) SLC5A1SLC5A2
SCHEMBL1728349 0.83 SLC5A2 (0.50) SLC5A1SLC5A2
SCHEMBL2266468 0.83 SLC5A1 (0.70) SLC5A1SLC5A2
SCHEMBL12367955 0.81 SLC5A1 (0.61) SLC5A1SLC5A2
SCHEMBL2269659 0.80 SLC5A1 (0.60) SLC5A1SLC5A2
SCHEMBL12367948 0.79 SLC5A1 (0.59) SLC5A1SLC5A2
SCHEMBL12367976 0.78 SLC5A1 (0.64) SLC5A1SLC5A2

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-7566699-B2 Fused heterocyclic derivative, medicinal composition containing the same, and medicinal use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-07-28 — — US disclosed
US-7566699-B2 Fused heterocyclic derivative, medicinal composition containing the same, and medicinal use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-07-28 — — US disclosed
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