SCHEMBL12667006

SCHEMBL12667006

COc1ccc(N)cc1NC(C)c1cc(C(=O)N(C)C)cc2c(=O)cc(N3CCOCC3)oc12

nearest known ligand 0.83

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 20/20 0.83
▸ PIK3CD O00329 7/20 0.68
▸ PIK3CA P42336 7/20 0.68
▸ PIK3CG P48736 7/20 0.68
▸ PIK3R1 P27986 1/20 0.65
▸ TOP2B Q02880 1/20 0.65
▸ ERN2 Q76MJ5 1/20 0.65

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
SCHEMBL1638056 0.91 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL1637715 0.89 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL12668365 0.83 PIK3CB (0.85) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL12666529 0.83 PIK3CB (0.79) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL1637728 0.82 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL1638481 0.81 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL1638221 0.80 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL12668363 0.80 PIK3CB (0.89) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL1638113 0.80 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL1638119 0.80 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CG

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-2011051704-A1 CHROMENONE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY ASTRAZENECA AB (SE) 2011-05-05 — — WO disclosed
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