SCHEMBL27414528

SCHEMBL27414528

OC[C@@H]1COC(n2ncc3c(NC4CCCC4)nc(Cl)nc32)O1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NT5E P21589 20/20 0.52

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
SCHEMBL21348635 0.84 NT5E (0.53) NT5E
SCHEMBL27414417 0.84 NT5E (0.53) NT5E
SCHEMBL31290227 0.80 NT5E (0.57) NT5E
SCHEMBL31290185 0.80 NT5E (0.57) NT5E
SCHEMBL23915097 0.79 NT5E (0.73) NT5E
SCHEMBL19366702 0.79 NT5E (0.73) NT5E
SCHEMBL24618960 0.77 NT5E (0.70) NT5E
SCHEMBL30008159 0.77 NT5E (0.49) NT5E
SCHEMBL19366711 0.77 NT5E (0.71) NT5E
SCHEMBL17265713 0.76 NT5E (0.51) 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-2024076873-A1 HETEROCYCLIC INHIBITORS OF CD73 FOR TREATMENT OF DISEASE TEON THERAPEUTICS, INC. (US) 2024-04-11 WO disclosed