SCHEMBL8466994

SCHEMBL8466994

CCCCCNc1ncnc2c1c(Br)cn2[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 18/20 0.62
▸ SLC29A1 Q99808 1/20 0.52

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
SCHEMBL8469111 0.88 SLC29A1 (0.68) ADKSLC29A1
SCHEMBL8461010 0.88 ADK (0.68) ADKSLC29A1
SCHEMBL8523300 0.87 ADK (0.61) ADKSLC29A1
SCHEMBL8464085 0.77 ADK (0.73) ADKSLC29A1
SCHEMBL8325888 0.76 ADK (1.00) ADKSLC29A1
SCHEMBL8331019 0.76 ADK (1.00) ADKSLC29A1
SCHEMBL8332000 0.76 ADK (1.00) ADK
SCHEMBL20917005 0.76 ADK (1.00) ADK
SCHEMBL22912606 0.76 ADK (1.00) ADK
SCHEMBL8523347 0.76 SLC29A1 (0.67) 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-0496617-B1 Adenosine kinase inhibitors METABASIS THERAPEUTICS INC (US) 1999-12-01 — — EP disclosed
US-5646128-A TREATING INFLAMMATION, SEPSIS, SEPTIC SHOCK, BURNS GENSIA, INC. (US) 1997-07-08 — — US disclosed
WO-1992012718-A1 ADENOSINE KINASE INHIBITORS GENSIA, INC. (US) 1992-08-06 — — WO disclosed
EP-0496617-A1 Adenosine kinase inhibitors GENSIA, INC. (US) 1992-07-29 — — EP disclosed
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