SCHEMBL28946367

SCHEMBL28946367

CC(C)[C@H](OC(=O)NC(C)(C)C)C(=O)Nc1ccc(-c2cnc(Cl)c(NS(=O)(=O)c3ccccc3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 15/20 0.54
PIK3CD O00329 14/20 0.54
PIK3CA P42336 10/20 0.54
PIK3CB P42338 9/20 0.54
PIK3C3 Q8NEB9 2/20 0.49
PI4KA P42356 1/20 0.49
PI4KB Q9UBF8 1/20 0.49
AKT1 P31749 1/20 0.47

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
SCHEMBL28800827 0.88 PIK3CG (0.58) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL28800828 0.88 PIK3CG (0.58) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL28946368 0.83 PIK3CD (0.53) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL22246654 0.83 PIK3CD (0.53) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL29808026 0.83 PIK3CD (0.53) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL29808233 0.82 PIK3CD (0.68) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL22246918 0.82 PIK3CD (0.68) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL28800832 0.82 PIK3CD (0.68) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL22230629 0.81 PIK3CG (0.64) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL22230631 0.81 PIK3CD (0.64) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109721531-B Novel liposome kinase inhibitor 中国科学院合肥物质科学研究院 2022-07-29 CN disclosed