SCHEMBL1873405

SCHEMBL1873405

O=C(c1cc(CCNc2cccc(Cl)c2F)c2oc(N3CCOCC3)cc(=O)c2c1)N1CCC(O)CC1

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 20/20 0.70
▸ PIK3CD O00329 5/20 0.52
▸ PIK3CA P42336 5/20 0.52
▸ PIK3CG P48736 5/20 0.52
▸ MTOR P42345 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ SPHK1 Q9NYA1 1/20 0.44

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
SCHEMBL1869350 0.88 PIK3CB (0.56) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1868030 0.87 PIK3CB (0.71) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL1871545 0.86 PIK3CB (0.56) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1866869 0.85 PIK3CB (0.70) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1866843 0.83 PIK3CB (0.74) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1636961 0.83 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CG
SCHEMBL1870413 0.82 PIK3CB (0.73) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1867622 0.80 PIK3CB (0.69) PIK3CBPIK3CDPIK3CAPIK3CGMTOR
SCHEMBL1869328 0.78 PIK3CB (0.66) PIK3CBPIK3CDPIK3CAPIK3CGMTOR
SCHEMBL1865599 0.78 PIK3CB (0.68) PIK3CBPIK3CDPIK3CAPIK3CGMTOR

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-2493870-A1 CHROMENONE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY AstraZeneca AB (SE) 2012-09-05 — — EP disclosed
WO-2011051704-A1 CHROMENONE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY ASTRAZENECA AB (SE) 2011-05-05 — — WO disclosed
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