SCHEMBL8322210

SCHEMBL8322210

OC[C@H]1O[C@@H](n2ccc3c(-c4ccccc4)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADK P55263 6/20 0.72

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
SCHEMBL313574 0.89 ADK (0.66) ADK
SCHEMBL20434127 0.89 ADK (0.66) ADK
SCHEMBL10131352 0.88 ADK (0.66) ADK
SCHEMBL314286 0.86 ADK (0.63) ADK
SCHEMBL20434122 0.86 ADK (0.63) ADK
SCHEMBL10131375 0.86 ADK (0.65) ADK
SCHEMBL10160936 0.86 ADK (0.68) ADK
SCHEMBL4098411 0.86 ADK (0.68) ADK
SCHEMBL314033 0.86 ADK (0.68) ADK
SCHEMBL314288 0.85 ADK (0.64) 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 3 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
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