SCHEMBL17338205

SCHEMBL17338205

CC(C)(C)OC(=O)N1CCN(n2c(CCNc3ncnc(N)c3C#N)nc3cccc(Cl)c3c2=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.53
PIK3R2 O00459 13/20 0.51
PIK3CG P48736 3/20 0.45
PIK3CA P42336 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
SCHEMBL17338250 0.92 PIK3CD (0.48) PIK3CDPIK3R2
SCHEMBL17338264 0.87 PIK3CD (0.69) PIK3CDPIK3R2PIK3CG
SCHEMBL17338324 0.85 PIK3CD (0.49) PIK3CDPIK3R2PIK3CG
SCHEMBL17338186 0.85 PIK3CD (0.48) PIK3CDPIK3R2PIK3CG
SCHEMBL17338218 0.84 PIK3CD (0.49) PIK3CDPIK3R2PIK3CG
SCHEMBL17330498 0.84 PIK3CD (0.76) PIK3CDPIK3R2PIK3CGPIK3CA
SCHEMBL17330499 0.84 PIK3CD (0.76) PIK3CDPIK3R2PIK3CGPIK3CA
SCHEMBL17338316 0.84 PIK3CD (0.50) PIK3CDPIK3R2
SCHEMBL17338213 0.84 PIK3CD (0.68) PIK3CDPIK3R2
SCHEMBL17330763 0.84 PIK3CD (0.74) PIK3CDPIK3R2

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-3154958-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS Gilead Sciences, Inc. (US) 2017-04-19 EP disclosed
WO-2015191752-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2015-12-17 WO disclosed