SCHEMBL245648

SCHEMBL245648

Cc1c(-c2ccccn2)nc2cc(F)cc(F)c2c1Nc1cc(N2CCOCC2)ncc1C1CCN(CC=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 7/20 0.56
PIK3CA P42336 19/20 0.44
PIK3CB P42338 6/20 0.38
PIK3CG P48736 4/20 0.38
PIK3R1 P27986 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
SCHEMBL247039 0.91 PIK3CD (0.63) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL3410299 0.88 PIK3CD (0.59) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL246264 0.88 PIK3CD (0.57) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL246090 0.88 PIK3CD (0.59) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL14840097 0.88 PIK3CD (0.58) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL247954 0.88 PIK3CD (0.60) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL245772 0.88 PIK3CD (0.58) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL14840096 0.87 PIK3CD (0.60) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL247580 0.86 PIK3CD (0.57) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL247705 0.85 PIK3CD (0.55) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588471-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY Amgen Inc. (US) 2013-05-08 EP disclosed
WO-2012003283-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 2012-01-05 WO disclosed