SCHEMBL17338241

SCHEMBL17338241

CC(C)(C)OC(=O)N1CCN(n2c(CCNc3nc(N)nc(N)c3Cl)nc3c(F)ccc(Cl)c3c2=O)CC1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.49
PIK3R2 O00459 13/20 0.49
PIK3CB P42338 3/20 0.40
TLR8 Q9NR97 1/20 0.39

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
SCHEMBL17338186 0.87 PIK3CD (0.48) PIK3CDPIK3R2
SCHEMBL17338394 0.84 CYP3A4 (0.40) PIK3CDPIK3R2
SCHEMBL17330494 0.83 PIK3CD (0.72) PIK3CDPIK3R2PIK3CB
SCHEMBL17330495 0.83 PIK3CD (0.72) PIK3CDPIK3R2PIK3CB
SCHEMBL17338330 0.83 PIK3CD (0.66) PIK3CDPIK3R2PIK3CB
SCHEMBL17338195 0.82 PIK3CD (0.43) PIK3CDPIK3R2
SCHEMBL17338253 0.82 PIK3CD (0.51) PIK3CDPIK3R2
SCHEMBL17338168 0.79 POLB (0.40)
SCHEMBL17338459 0.78 CYP3A4 (0.38)
SCHEMBL17338250 0.77 PIK3CD (0.48) PIK3CDPIK3R2PIK3CB

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