SCHEMBL30185598

SCHEMBL30185598

Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1cc(Cl)c2c(c1)CN(C(C)C1CC1)C2=O

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 18/20 0.72
PIK3CA P42336 12/20 0.72
PIK3CD O00329 10/20 0.72
PIK3R1 P27986 8/20 0.72
PIK3CB P42338 6/20 0.72
CLK4 Q9HAZ1 1/20 0.60
STK17A Q9UEE5 1/20 0.60
KCNH2 Q12809 2/20 0.57
PIK3C2B O00750 1/20 0.57
PIK3C2G O75747 1/20 0.57
PIK3C3 Q8NEB9 1/20 0.57

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
SCHEMBL29099571 1.00 PIK3CG (0.72) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL29099569 0.93 PIK3CA (0.61) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL30185556 0.93 PIK3CA (0.61) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL30185575 0.88 PIK3CA (0.57) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL30185555 0.88 PIK3CA (0.57) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL29099542 0.88 PIK3CA (0.57) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL29099551 0.86 PIK3CA (0.55) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL30185549 0.86 PIK3CA (0.55) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL30185561 0.86 PIK3CA (0.60) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL29099549 0.86 PIK3CA (0.60) PIK3CGPIK3CAPIK3CDPIK3R1PIK3CB

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
CN-115611883-B PI3K alpha inhibitor with double-ring structure, and preparation method and application thereof 生物岛实验室 2025-03-28 CN disclosed
CN-115611883-A PI3K alpha inhibitor with bicyclic structure and preparation method and application thereof 生物岛实验室 2023-01-17 CN disclosed