SCHEMBL8330784

SCHEMBL8330784

OCC[C@@H]1O[C@@H](n2cc(I)c3c(Cl)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADK P55263 18/20 0.83
SLC29A1 Q99808 1/20 0.83

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
SCHEMBL8332076 0.91 ADK (1.00) ADKSLC29A1
SCHEMBL13005612 0.91 ADK (1.00) ADKSLC29A1
SCHEMBL20418988 0.91 ADK (1.00) ADKSLC29A1
SCHEMBL14111715 0.91 ADK (1.00) ADKSLC29A1
SCHEMBL4019484 0.91 ADK (1.00) ADKSLC29A1
SCHEMBL8332793 0.88 ADK (0.83) ADKSLC29A1
SCHEMBL8332340 0.88 ADK (0.83) ADKSLC29A1
SCHEMBL2038994 0.87 ADK (1.00) ADKSLC29A1
SCHEMBL8975829 0.86 ADK (0.69) ADKSLC29A1
SCHEMBL8975253 0.86 ADK (0.79) ADKSLC29A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0684953-A4 ADENOSINE KINASE INHIBITORS COMPRISING LYXOFURANOSYL DERIVATIVES. GENSIA INC (US) 1999-12-22 EP disclosed
US-5506347-A ADENOSINE KINASE INHIBITOR GENSIA, INC. (US) 1996-04-09 US disclosed
EP-0684953-A1 ADENOSINE KINASE INHIBITORS COMPRISING LYXOFURANOSYL DERIVATIVES GENSIA, INC. (US) 1995-12-06 EP disclosed
WO-1994018215-A1 ADENOSINE KINASE INHIBITORS COMPRISING LYXOFURANOSYL DERIVATIVES GENSIA, INC. (US) 1994-08-18 WO disclosed