SCHEMBL30727657

SCHEMBL30727657

COc1ncc(-n2cc3c(N4C[C@H]5CCC[C@H]5C4)ncnc3n2)c(OC)n1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 17/20 0.35
PIK3CA P42336 3/20 0.34
PIK3CD O00329 1/20 0.33

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
SCHEMBL30727639 0.89 PIK3CA (0.35) NAMPTPIK3CAPIK3CD
SCHEMBL30727738 0.89 PIK3CA (0.35) NAMPTPIK3CAPIK3CD
SCHEMBL30727724 0.84 ABL1 (0.38) NAMPTPIK3CAPIK3CD
SCHEMBL30727698 0.82 SLC2A1 (0.32)
SCHEMBL30727667 0.80 NAMPT (0.30) NAMPT
SCHEMBL30727650 0.79 SIGMAR1 (0.37) NAMPTPIK3CAPIK3CD
SCHEMBL30727646 0.78
SCHEMBL30727701 0.78
SCHEMBL30727688 0.78
SCHEMBL30727782 0.76 PIK3CD (0.33) PIK3CAPIK3CD

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
EP-4532495-A1 CD73 INHIBITOR COMPOUNDS Adorx therapeutics Limited (GB) 2025-04-09 EP disclosed
WO-2023233130-A1 CD73 INHIBITOR COMPOUNDS AdoRx Therapeutics Limited (GB) 2023-12-07 WO disclosed