SCHEMBL29687640

SCHEMBL29687640

COc1ccc(Cc2ccccc2OC2OC(COC(=O)O)C(O)C(O)C2O)cc1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC5A2 P31639 17/20 0.81
▸ SLC5A1 P13866 11/20 0.81
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ ACHE P22303 1/20 0.47

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
SCHEMBL14634631 1.00 SLC5A2 (0.81) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL14634632 0.93 SLC5A2 (0.93) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL14634627 0.93 SLC5A2 (0.93) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL874080 0.93 SLC5A2 (0.93) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL4355551 0.92 SLC5A2 (0.81) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL4355545 0.92 SLC5A2 (0.81) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL4360297 0.91 SLC5A2 (0.86) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL4359339 0.91 SLC5A2 (0.79) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL4359333 0.91 SLC5A2 (0.79) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL4360304 0.91 SLC5A2 (0.86) SLC5A2SLC5A1NPC1RAB9AACHE

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
WO-2022117893-A2 COMBINATION THERAPY FOR PATIENTS HAVING ACUTE AND/OR PERSISTENT DYSPNEA S-FORM PHARMA (BE) 2022-06-09 — — WO claimed
WO-2022117893-A2 COMBINATION THERAPY FOR PATIENTS HAVING ACUTE AND/OR PERSISTENT DYSPNEA S-FORM PHARMA (BE) 2022-06-09 — — WO disclosed
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