SCHEMBL3414849

SCHEMBL3414849

CC[C@@H](C)Cc1nc2cc(I)ccc2cc1[C@H](C)Nc1ncnc2[nH]cnc12

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 2/20 0.36
PIK3CD O00329 5/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36

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
SCHEMBL247211 0.90 PIK3CD (0.47) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL248314 0.90 PIK3CD (0.47) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL247212 0.90 PIK3CD (0.47) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL248494 0.81 PIK3CD (0.49) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL10076744 0.81 PIK3CD (0.49) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL246482 0.79 PIK3CD (0.49) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL249839 0.79 PIK3CD (0.49) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL3414056 0.77 PIK3CD (0.47) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL249676 0.77 PIK3CD (0.47) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL250360 0.77 PIK3CD (0.49) PIK3CGPIK3CDPIK3CAPIK3CB

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-2012003271-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 2012-01-05 WO disclosed