SCHEMBL24672848

SCHEMBL24672848

CONc1nc(Cl)nc2c1cnn2[C@H]1CC[C@@H](COP(=O)(O)CP(=O)(O)O)O1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NT5E P21589 20/20 0.57

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
SCHEMBL21869767 0.91 NT5E (0.56) NT5E
SCHEMBL24672486 0.85 NT5E (0.59) NT5E
SCHEMBL21869543 0.83 NT5E (0.62) NT5E
SCHEMBL21869649 0.83 NT5E (0.64) NT5E
SCHEMBL30008031 0.81 NT5E (0.78) NT5E
SCHEMBL27206860 0.81 NT5E (0.78) NT5E
SCHEMBL27195143 0.81 NT5E (0.78) NT5E
SCHEMBL21869421 0.81 NT5E (0.54) NT5E
SCHEMBL21869619 0.78 NT5E (0.72) NT5E
SCHEMBL21869496 0.76 NT5E (0.76) 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