SCHEMBL323317

SCHEMBL323317

COc1ncc(N2CCc3ncnc(OC4CN(C(=O)C5CCOCC5)C4)c3C2)cc1C(F)(F)F.COc1ncc(N2CCc3ncnc(OC4CN(C(=O)OC(C)(C)C)C4)c3C2)cc1C(F)(F)F

nearest known ligand 0.89

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.89
PIK3CA P42336 20/20 0.89
PIK3CB P42338 4/20 0.82
PIK3CG P48736 2/20 0.66

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
SCHEMBL322505 0.94 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL323155 0.92 PIK3CD (0.74) PIK3CDPIK3CAPIK3CB
SCHEMBL322463 0.90 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL322464 0.90 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
Trifluoroacetic Acid SCHEMBL321678 0.90 PIK3CD (0.70) PIK3CDPIK3CAPIK3CB
SCHEMBL322446 0.89 PIK3CD (0.81) PIK3CDPIK3CAPIK3CB
SCHEMBL322445 0.89 PIK3CD (0.81) PIK3CDPIK3CAPIK3CB
Trifluoroacetic Acid SCHEMBL323117 0.86 PIK3CD (0.76) PIK3CDPIK3CAPIK3CB
SCHEMBL440081 0.84 PIK3CD (1.00) PIK3CDPIK3CAPIK3CB
SCHEMBL404350 0.84 PIK3CD (1.00) PIK3CDPIK3CAPIK3CB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2790705-A1 USE OF INHIBITORS OF THE ACTIVITY OR FUNCTION OF PI3K Novartis AG (CH) 2014-10-22 EP disclosed
WO-2013088404-A1 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2013-06-20 WO disclosed
EP-2590974-A1 TETRAHYDRO-PYRIDO-PYRIMIDINE DERIVATIVES Novartis AG (CH) 2013-05-15 EP disclosed
WO-2012004299-A1 TETRAHYDRO-PYRIDO-PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2012-01-12 WO disclosed