SCHEMBL12667220

SCHEMBL12667220

CNC(=C1CC1)c1cc(C(C)Nc2cc(F)cc(F)c2)c2oc(N3CCOCC3)cc(=O)c2c1

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 20/20 0.80
▸ PIK3CD O00329 9/20 0.80
▸ PIK3CA P42336 9/20 0.80
▸ PIK3CG P48736 9/20 0.80
▸ PIK3R1 P27986 1/20 0.73
▸ TOP2B Q02880 1/20 0.73
▸ ERN2 Q76MJ5 1/20 0.73

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
SCHEMBL1637014 0.89 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL1639382 0.87 PIK3CB (0.83) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL24713615 0.86 PIK3CB (0.78) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL15867054 0.85 PIK3CB (0.81) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL1637702 0.85 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
Azd-8186 SCHEMBL1636956 0.84 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL1637233 0.84 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
SCHEMBL1637763 0.84 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
Azd-8186 SCHEMBL1638875 0.84 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1
Azd-8186 SCHEMBL1638635 0.84 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGPIK3R1

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
Send feedback