SCHEMBL8975769

SCHEMBL8975769

C[C@H]1O[C@@H](n2nc(-c3ccccc3)c3c(NCc4ccncc4)ncnc32)[C@@H](O)[C@H]1O

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 20/20 0.66

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
SCHEMBL8975693 0.91 ADK (0.63) ADK
SCHEMBL8975239 0.89 ADK (0.71) ADK
SCHEMBL8975172 0.88 ADK (0.66) ADK
SCHEMBL8975449 0.82 ADK (0.75) ADK
SCHEMBL8975415 0.79 ADK (0.68) ADK
SCHEMBL8896158 0.79 ADK (0.53) ADK
SCHEMBL8975662 0.79 ADK (0.60) ADK
SCHEMBL8324918 0.78 ADK (0.58) ADK
SCHEMBL8975871 0.78 ADK (0.69) ADK
SCHEMBL8975864 0.78 ADK (0.69) ADK

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
US-5506347-A ADENOSINE KINASE INHIBITOR GENSIA, INC. (US) 1996-04-09 — — US disclosed
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