SCHEMBL17338341

SCHEMBL17338341

CN1CCC(n2c(CCNc3ncnc4[nH]cnc34)nc3cccc(Cl)c3c2=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.56
PIK3R2 O00459 8/20 0.42
PIK3CG P48736 6/20 0.42

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
SCHEMBL17338297 0.89 PIK3CD (0.59) PIK3CDPIK3R2PIK3CG
SCHEMBL17338292 0.89 PIK3CD (0.59) PIK3CDPIK3R2PIK3CG
SCHEMBL17338328 0.83 PIK3CD (0.69) PIK3CDPIK3R2PIK3CG
SCHEMBL17330603 0.82 PIK3CD (0.79) PIK3CDPIK3R2PIK3CG
SCHEMBL17330598 0.82 PIK3CD (0.79) PIK3CDPIK3R2PIK3CG
SCHEMBL14993340 0.79 PIK3CD (0.51) PIK3CDPIK3CG
SCHEMBL935387 0.78 PIK3CD (0.43) PIK3CDPIK3R2PIK3CG
SCHEMBL17338310 0.78 PIK3CD (0.49) PIK3CDPIK3R2
SCHEMBL17338206 0.77 PIK3CD (0.46) PIK3CDPIK3R2PIK3CG
SCHEMBL5607394 0.76 PIK3CD (0.53) PIK3CDPIK3R2PIK3CG

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 claimed
WO-2015191752-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2015-12-17 WO claimed