SCHEMBL3877450

SCHEMBL3877450

OC[C@H]1O[C@@H](Nc2nc(F)nc3nc[nH]c23)[C@@H](O)[C@@H]1O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 1/20 0.43
▸ GSK3B P49841 1/20 0.42
▸ TSHR P16473 1/20 0.39
▸ CA1 P00915 9/20 0.38
▸ CA2 P00918 9/20 0.38
▸ CA12 O43570 3/20 0.36
▸ CA9 Q16790 3/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PNP P00491 1/20 0.35

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
SCHEMBL2873813 1.00 ADK (0.43) ADKGSK3BTSHRCA1CA2
SCHEMBL6886938 0.86 XDH (0.48) ADKGSK3B
SCHEMBL3691849 0.85 ADORA1 (0.37) ADKGSK3B
SCHEMBL6305780 0.84 CA5A (0.43) —
SCHEMBL29022774 0.78 GDA (0.48) GSK3B
SCHEMBL28631534 0.78 GDA (0.48) GSK3B
SCHEMBL28542110 0.78 GDA (0.48) GSK3B
SCHEMBL5472025 0.77 CDK1 (0.42) ADK
SCHEMBL5474432 0.77 CDK1 (0.42) ADK
SCHEMBL31108455 0.77 GDA (0.47) GSK3B

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107109458-B Cell-based defibrotide potency assay 真蒂奥姆责任有限公司 2021-10-26 — — CN disclosed
EP-2107909-A2 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF LIVER DISORDERS IDENIX Pharmaceuticals, Inc. (US) 2009-10-14 — — EP disclosed
WO-2008082602-A2 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF LIVER DISORDERS IDENIX PHARMACEUTICALS, INC. (US) 2008-07-10 — — WO disclosed
EP-1439220-B1 Immobilized biocatalysts usable for the manufacture of natural nucleosides and modified analogues through enzymatic transglycosylation reactions ADORKEM TECHNOLOGY SPA (IT) 2007-08-22 — — EP disclosed
US-20040142438-A1 Novel immobilized biocatalysts usable for the production of natural nucleosides and modified analogues by enzymatic transglycosylation reactions KERYOS SPA (IT) 2004-07-22 — — US disclosed
EP-1439220-A1 Immobilized biocatalysts usable for the manufacture of natural nucleosides and modified analogues through enzymatic transglycosylation reactions Keryos Spa (IT) 2004-07-21 — — EP disclosed
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