SCHEMBL10264341

SCHEMBL10264341

COc1ncc(N2CCc3ncnc(O)c3C2)cc1N

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.49
PIK3CA P42336 16/20 0.47
PIK3CB P42338 3/20 0.45
PIK3CG P48736 1/20 0.45

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
SCHEMBL322038 0.88 PIK3CD (0.55) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL323078 0.88 PIK3CD (0.62) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL1911794 0.88 PIK3CD (0.58) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL1911826 0.88 PIK3CD (0.51) PIK3CDPIK3CAPIK3CB
SCHEMBL1911793 0.85 PIK3CD (0.61) PIK3CDPIK3CAPIK3CB
SCHEMBL439992 0.84 PIK3CD (0.61) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL1911829 0.84 PIK3CD (0.41) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL1911801 0.79 PIK3CD (0.46) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL1911813 0.79 PIK3CD (0.62) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL15721591 0.79 PIK3CD (0.53) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012004299-A1 TETRAHYDRO-PYRIDO-PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2012-01-12 WO disclosed