SCHEMBL21337664

SCHEMBL21337664

Cc1nn(C(C)c2oc(=O)c3ccccc3c2C2=CCN(C)CC2)c2ncnc(N)c12

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 18/20 0.40
▸ PIK3CA P42336 2/20 0.36
▸ PIK3CB P42338 2/20 0.36
▸ PIK3CG P48736 2/20 0.36
▸ PIK3R1 P27986 1/20 0.35
▸ CSNK1E P49674 1/20 0.35
▸ PIK3C2B O00750 1/20 0.35

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
SCHEMBL16806425 0.92 PIK3CD (0.37) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
Hydrochloric Acid SCHEMBL16783635 0.91 PIK3CD (0.36) PIK3CDPIK3CGPIK3R1CSNK1EPIK3C2B
SCHEMBL21337803 0.89 PIK3CD (0.38) PIK3CDPIK3CAPIK3CBPIK3CG
Formic Acid SCHEMBL16783586 0.88 PIK3CD (0.35) PIK3CDPIK3CGPIK3R1CSNK1EPIK3C2B
SCHEMBL21337762 0.87 PIK3CD (0.45) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL21337788 0.87 ATR (0.39) PIK3CDPIK3CAPIK3CBPIK3CGPIK3C2B
SCHEMBL21337670 0.87 PIK3CD (0.40) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL16783407 0.85 PIK3CD (0.44) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL16783612 0.85 PIK3CD (0.47) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL21337782 0.85 PIK3CD (0.40) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1

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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