SCHEMBL16266147

SCHEMBL16266147

COc1ncc(-c2cc(-c3ncc(CN4CCN(C(C)C)CC4)o3)c3cn[nH]c3c2)cc1CN[SH](=O)=O

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.64
PIK3CA P42336 14/20 0.57
PIK3CB P42338 12/20 0.57
PIK3CG P48736 11/20 0.57
PIK3R2 O00459 1/20 0.56
PIK3R1 P27986 10/20 0.36

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
SCHEMBL16667395 0.90 PIK3CD (0.53) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL16266146 0.87 PIK3CD (0.74) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL16266140 0.87 PIK3CD (0.74) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL461788 0.87 PIK3CD (0.66) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL659765 0.85 PIK3CD (0.77) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL19859026 0.85 PIK3CD (0.81) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL19859021 0.85 PIK3CD (0.78) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL13075809 0.84 PIK3CD (0.64) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL16667391 0.80 PIK3CD (0.49) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2
SCHEMBL19859027 0.80 PIK3CD (0.91) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3260453-B1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS GLAXO GROUP LTD (GB) 2021-03-31 EP claimed
EP-2613781-B1 INDAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF INFLUENZA VIRUS INFECTION GLAXOSMITHKLINE IP DEV LTD (GB) 2016-08-24 EP claimed
EP-2424864-B1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS GLAXO GROUP LTD (GB) 2014-12-03 EP claimed