SCHEMBL24672818

SCHEMBL24672818

CC(C)ONc1cc(Cl)nc2c1cnn2[C@@H]1O[C@H](COP(=O)(O)CP(=O)(O)O)C[C@H]1O

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NT5E P21589 19/20 0.55

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
SCHEMBL24672052 0.86 NT5E (0.72) NT5E
SCHEMBL30007757 0.86 NT5E (0.72) NT5E
SCHEMBL22843549 0.83 NT5E (0.79) NT5E
SCHEMBL24452691 0.80 NT5E (0.64) NT5E
SCHEMBL24672486 0.80 NT5E (0.59) NT5E
SCHEMBL22628297 0.79 NT5E (0.52) NT5E
SCHEMBL22628295 0.79 NT5E (0.52) NT5E
SCHEMBL24672762 0.77 NT5E (0.71) NT5E
SCHEMBL24672815 0.77 NT5E (0.71) NT5E
SCHEMBL30008151 0.77 NT5E (0.71) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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