SCHEMBL17338191

SCHEMBL17338191

CC(C)(C)OC(=O)N1CCC(n2c(CCNc3ncnc4scnc34)nc3cccc(Cl)c3c2=O)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3R2 O00459 16/20 0.52
PIK3CD O00329 8/20 0.52
PIK3CG P48736 2/20 0.44
RIPK2 O43353 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38

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
SCHEMBL17338258 0.88 PIK3CD (0.53) PIK3R2PIK3CDPIK3CG
SCHEMBL17338182 0.86 PIK3CD (0.49) PIK3R2PIK3CDPIK3CGCNR1CNR2
SCHEMBL17338352 0.85 PIK3CD (0.68) PIK3R2PIK3CDPIK3CG
SCHEMBL17338190 0.84 PIK3CD (0.74) PIK3R2PIK3CDPIK3CG
SCHEMBL22493120 0.84 PIK3CD (0.74) PIK3R2PIK3CDPIK3CG
SCHEMBL17338208 0.84 PIK3CD (0.52) PIK3R2PIK3CDPIK3CG
SCHEMBL17338211 0.81 PIK3CD (0.49) PIK3R2PIK3CDPIK3CG
SCHEMBL17338223 0.79 OPRM1 (0.44) PIK3CD
SCHEMBL17338221 0.79 PIK3CD (0.48) PIK3R2PIK3CDPIK3CG
SCHEMBL17338184 0.79 OPRM1 (0.44) PIK3CD

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