SCHEMBL30727650

SCHEMBL30727650

COc1ncc(-n2cc3c(N4CCC(C)(C)C4)ncnc3n2)c(OC)n1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.37
KIT P10721 2/20 0.33
NAMPT P43490 1/20 0.32
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
JAK3 P52333 1/20 0.30

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
SCHEMBL30727654 0.89 KIT (0.31) KITNAMPT
SCHEMBL30727696 0.88 NAMPT (0.31) NAMPT
SCHEMBL30727698 0.85 SLC2A1 (0.32)
SCHEMBL30727646 0.83
SCHEMBL30727701 0.83
SCHEMBL30727688 0.83
SCHEMBL30727661 0.83
SCHEMBL30727724 0.80 ABL1 (0.38) NAMPTPIK3CDPIK3CA
SCHEMBL30727657 0.79 NAMPT (0.35) NAMPTPIK3CDPIK3CA
SCHEMBL30727738 0.78 PIK3CA (0.35) NAMPTPIK3CDPIK3CA

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 3 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
CN-119585273-A CD73 inhibitor compounds 阿道尔克斯治疗有限公司 2025-03-07 CN disclosed
WO-2023233130-A1 CD73 INHIBITOR COMPOUNDS AdoRx Therapeutics Limited (GB) 2023-12-07 WO disclosed