SCHEMBL5322864

SCHEMBL5322864

Cc1nc(NC(=O)Nc2ccc(O)cc2)sc1-c1ccc(Cl)c(S(C)(=O)=O)c1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.68
PIK3CG P48736 14/20 0.68
PIK3C3 Q8NEB9 3/20 0.68
PI4KB Q9UBF8 5/20 0.62
PIK3CA P42336 10/20 0.60
PIK3CB P42338 8/20 0.60
PIK3C2A O00443 1/20 0.54
PIK3C2B O00750 1/20 0.54
PI4KA P42356 1/20 0.54
PRKDC P78527 1/20 0.54
PIK3C2G O75747 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.47
MEN1 O00255 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL48667 0.90 PIK3CD (0.60) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL49041 0.86 PIK3CD (0.66) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL5321637 0.85 PIK3CD (0.51) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL49279 0.85 PIK3CG (0.56) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL48786 0.84 PIK3CD (0.54) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL48392 0.84 PIK3CG (0.83) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL49493 0.84 PIK3CG (0.62) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL48896 0.84 PIK3CD (0.62) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL48762 0.83 PIK3CD (0.67) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA
SCHEMBL48988 0.82 PIK3CD (0.61) PIK3CDPIK3CGPIK3C3PI4KBPIK3CA

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-2007129005-A1 AMINOACID DERIVATIVES OF THIAZOLES AS INHIBITORS OF PI3 KINASE CHROMA THERAPEUTICS LTD. (GB) 2007-11-15 WO disclosed