SCHEMBL22336672

SCHEMBL22336672

CCNS(=O)(=O)c1cc(-c2sc(NC(=O)C(C)(C)C)nc2C)ccc1OC

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.83
PI4KB Q9UBF8 14/20 0.75
PIK3CG P48736 4/20 0.73
PIK3C2G O75747 3/20 0.73
PIK3CA P42336 2/20 0.73

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
SCHEMBL24535632 0.89 PIK3CD (0.78) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL29265065 0.87 PIK3CD (0.81) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL22338451 0.86 PIK3CD (0.74) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL24535456 0.86 PIK3CD (0.84) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL22336563 0.86 PI4KB (0.74) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL22336531 0.85 PIK3CD (0.85) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL29265066 0.84 PIK3CD (0.71) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL24535575 0.84 PIK3CD (0.86) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL14851574 0.84 PIK3CD (1.00) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA
SCHEMBL29420845 0.84 PIK3CD (1.00) PIK3CDPI4KBPIK3CGPIK3C2GPIK3CA

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
WO-2020163598-A1 IMMUNOPHILIN-DEPENDENT INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-08-13 WO disclosed