SCHEMBL27873587

SCHEMBL27873587

CC(O)c1cc(CC(=O)O)cc2c(=O)cc(N3CCOCC3)oc12

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 17/20 0.50
▸ PIK3CA P42336 10/20 0.50
▸ PIK3CD O00329 9/20 0.50
▸ PIK3CG P48736 9/20 0.50
▸ PRKDC P78527 3/20 0.50
▸ KCNH2 Q12809 1/20 0.48

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
SCHEMBL1639079 0.84 PIK3CB (0.60) PIK3CBPIK3CAPIK3CDPIK3CGKCNH2
SCHEMBL27889939 0.84 PRKDC (0.57) PIK3CBPIK3CAPIK3CDPIK3CGPRKDC
SCHEMBL24714319 0.83 PIK3CB (0.71) PIK3CBPIK3CAPIK3CDPIK3CG
SCHEMBL28095991 0.82 PIK3CB (0.48) PIK3CBPIK3CAPIK3CDPIK3CGPRKDC
SCHEMBL28946196 0.82 PIK3CA (0.50) PIK3CBPIK3CAPIK3CDPIK3CGPRKDC
SCHEMBL1637732 0.79 PIK3CB (0.56) PIK3CBPIK3CAPIK3CDPIK3CGPRKDC
SCHEMBL1639091 0.79 PIK3CB (0.73) PIK3CBPIK3CAPIK3CDPIK3CGKCNH2
SCHEMBL27873586 0.79 PIK3CB (0.51) PIK3CBPIK3CAPIK3CDPIK3CGPRKDC
SCHEMBL1639036 0.79 PIK3CB (0.70) PIK3CBPIK3CAPIK3CDPIK3CG
SCHEMBL27873650 0.78 PIK3CB (0.73) PIK3CBPIK3CAPIK3CDPIK3CGPRKDC

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
CN-104447657-A CHROMENONE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY ASTRAZENECA AB 2015-03-25 — — CN disclosed
CN-102712615-B Chromenone Derivatives with Antitumor Activity ASTRAZENECA AB 2014-12-17 — — CN disclosed
CN-102712615-A Chromenone Derivatives with Antitumor Activity ASTRAZENECA AB 2012-10-03 — — CN disclosed
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