SCHEMBL30008411

SCHEMBL30008411

CONc1nc(Cl)nc2c1cnn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NT5E P21589 17/20 0.54
ADORA3 P0DMS8 1/20 0.53

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
SCHEMBL27195120 1.00 NT5E (0.54) NT5EADORA3
SCHEMBL30008325 0.89 NT5E (0.56) NT5E
SCHEMBL27195155 0.89 NT5E (0.56) NT5E
SCHEMBL30008238 0.85 NT5E (0.59) NT5E
SCHEMBL27195210 0.85 NT5E (0.42) NT5EADORA3
SCHEMBL30008792 0.85 NT5E (0.42) NT5EADORA3
SCHEMBL30008194 0.83 NT5E (0.56) NT5EADORA3
SCHEMBL23915097 0.83 NT5E (0.73) NT5EADORA3
SCHEMBL19366702 0.83 NT5E (0.73) NT5EADORA3
SCHEMBL24618960 0.83 NT5E (0.70) NT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117642411-A Small molecule CD73 antagonists and uses thereof 西藏海思科制药有限公司 2024-03-01 CN disclosed
WO-2022237747-A1 SMALL MOLECULAR CD73 ANTAGONIST AND USE THEREOF 四川海思科制药有限公司 2022-11-17 WO disclosed