SCHEMBL8332000

SCHEMBL8332000

C[C@H]1O[C@@H](n2cc(Br)c3c(N)ncnc32)[C@@H](O)[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 14/20 1.00
▸ METTL3 Q86U44 6/20 0.63

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
SCHEMBL22912606 1.00 ADK (1.00) ADKMETTL3
SCHEMBL20917005 1.00 ADK (1.00) ADKMETTL3
5-Iodo,5'-Deoxytubercidin SCHEMBL8331903 0.85 ADK (1.00) ADK
SCHEMBL8331019 0.85 ADK (1.00) ADK
SCHEMBL8325888 0.85 ADK (1.00) ADK
5-Iodo,5'-Deoxytubercidin SCHEMBL6236636 0.85 ADK (1.00) ADK
SCHEMBL21413834 0.85 ADK (0.76) ADK
SCHEMBL11054818 0.85 ADK (0.76) ADK
SCHEMBL8330661 0.84 ADK (1.00) ADKMETTL3
SCHEMBL24293915 0.83 ADK (0.75) ADKMETTL3

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
Send feedback