SCHEMBL21337751

SCHEMBL21337751

Cc1nn(C(C)c2oc(=O)c3ccccc3c2-c2ccc(C3OC(C)(C)C(C)(C)O3)s2)c2ncnc(N)c12

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 20/20 0.38
▸ PIK3CA P42336 2/20 0.34
▸ PIK3CB P42338 2/20 0.34
▸ PIK3CG P48736 2/20 0.34
▸ PIK3R1 P27986 1/20 0.34
▸ CSNK1E P49674 1/20 0.34

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
SCHEMBL16783896 0.92 PIK3CD (0.35) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL16783698 0.85 PIK3CD (0.49) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL24494695 0.81 PIK3CD (0.43) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL22505055 0.81 PIK3CD (0.40) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL24494696 0.81 PIK3CD (0.45) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL21337718 0.81 PIK3CD (0.42) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL16783540 0.80 PIK3CD (0.46) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL21337793 0.80 PIK3CD (0.45) PIK3CDPIK3CBPIK3CGPIK3R1CSNK1E
SCHEMBL21337779 0.78 PIK3CD (0.47) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL16783653 0.76 MEN1 (0.31) —

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
EP-3083617-B1 ISOCHROMENE DERIVATIVES AS PHOSPHOINOSITIDE 3-KINASES INHIBITORS CHIESI FARM SPA (IT) 2019-09-11 — — EP disclosed
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