SCHEMBL3262808

SCHEMBL3262808

CS(=O)(=O)c1cncc(-c2ccn3nc(N)nc3c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 20/20 1.00
PIK3CD O00329 15/20 0.80
PIK3CA P42336 5/20 0.72
PIK3CB P42338 4/20 0.72
PAK4 O96013 1/20 0.72
JAK1 P23458 1/20 0.72
CSNK1A1 P48729 1/20 0.72
AAK1 Q2M2I8 1/20 0.72
PIP4K2C Q8TBX8 1/20 0.72
CSNK1G1 Q9HCP0 1/20 0.72
PI4KA P42356 1/20 0.49
PI4KB Q9UBF8 1/20 0.49

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
SCHEMBL3228404 0.89 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL3234736 0.87 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL3226533 0.85 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL3260998 0.85 PIK3CG (0.73) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL3226438 0.84 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL3221575 0.84 PIK3CG (0.82) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL3226712 0.84 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL3231244 0.84 PIK3CG (0.84) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL13536557 0.83 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL936625 0.82 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPAK4

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
WO-2010007100-A1 7-SUBSTITUTED AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LTD (GB) 2010-01-21 WO claimed
WO-2010007100-A1 7-SUBSTITUTED AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LTD (GB) 2010-01-21 WO disclosed