SCHEMBL22716935

SCHEMBL22716935

COc1ccc(Cc2c(C)cc(OC)nc2OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC5A2 P31639 19/20 0.68
▸ SLC5A1 P13866 17/20 0.68
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50

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
SCHEMBL29572195 1.00 SLC5A2 (0.68) SLC5A2SLC5A1NPC1RAB9A
SCHEMBL4359089 1.00 SLC5A2 (0.68) SLC5A2SLC5A1NPC1RAB9A
SCHEMBL4359584 0.92 SLC5A2 (0.68) SLC5A2SLC5A1NPC1RAB9A
SCHEMBL5383101 0.85 SLC5A2 (0.69) SLC5A2SLC5A1
SCHEMBL4000126 0.82 SLC5A2 (0.64) SLC5A2SLC5A1NPC1RAB9A
SCHEMBL4000120 0.82 SLC5A2 (0.64) SLC5A2SLC5A1NPC1RAB9A
SCHEMBL4350692 0.82 SLC5A2 (0.67) SLC5A2SLC5A1
SCHEMBL2252419 0.81 SLC5A2 (1.00) SLC5A2SLC5A1
SCHEMBL4358723 0.81 SLC5A2 (0.58) SLC5A2SLC5A1
SCHEMBL5381328 0.80 SLC5A2 (0.57) 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
WO-2020242537-A1 COMPOSITIONS AND METHODS FOR TREATING METABOLIC DISEASE AVOLYNT (US) 2020-12-03 — — WO disclosed
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