SCHEMBL30727720

SCHEMBL30727720

COc1ncc(-c2cc3c(N4CCC(OCCN5CCCCC5)C4)c(C#N)cnc3s2)c(OC)n1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.36
PIK3CA P42336 2/20 0.36
SRC P12931 5/20 0.35
PRKCQ Q04759 2/20 0.35
ENPP1 P22413 5/20 0.33
MELK Q14680 1/20 0.33
PDGFRB P09619 2/20 0.33
PRKCD Q05655 1/20 0.31
RET P07949 1/20 0.31
CHRM4 P08173 2/20 0.31

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
SCHEMBL30727682 0.84 PIK3CD (0.39) PIK3CDPIK3CA
SCHEMBL30727569 0.80 PRKCQ (0.33) PIK3CDPIK3CASRCPRKCQENPP1
SCHEMBL30727745 0.73 KRAS (0.37) PIK3CDPIK3CA
SCHEMBL30727670 0.73 PDE10A (0.34) PIK3CD
SCHEMBL30727733 0.71 PDE10A (0.37)
SCHEMBL30727741 0.70 PRKCQ (0.36) PIK3CASRCPRKCQPRKCD
SCHEMBL30727729 0.69 KIT (0.36)
SCHEMBL30727695 0.69 PIK3CD (0.38) PIK3CDPIK3CA
SCHEMBL30727739 0.68 PIK3CA (0.41) PIK3CDPIK3CA
SCHEMBL30727676 0.68 PLAU (0.32)

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