SCHEMBL6276205

SCHEMBL6276205

COc1cncc(Nc2nc(C)c(-c3ccc(S(N)(=O)=O)c(C)c3)s2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PIK3CD O00329 10/20 0.40
PIK3CG P48736 9/20 0.40
PIK3CA P42336 7/20 0.40
PIK3CB P42338 6/20 0.40
PI4KB Q9UBF8 6/20 0.38
PIK3C3 Q8NEB9 1/20 0.36
PIK3C2G O75747 3/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PI4KA P42356 1/20 0.35

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
SCHEMBL2396147 0.86 MEN1 (0.56) MEN1KMT2APIK3CDPIK3CGPIK3CA
SCHEMBL2393257 0.79 MEN1 (0.43) MEN1KMT2APIK3CDPIK3CGPIK3CA
SCHEMBL2395028 0.76 PIK3CD (0.49) PIK3CDPIK3CGPIK3CAPI4KBPIK3C2G
SCHEMBL2397546 0.75 PIK3C2G (0.47) MEN1KMT2APIK3CDPIK3CGPIK3CA
SCHEMBL2398117 0.73 PIK3CD (0.50) MEN1KMT2APIK3CDPIK3CGPIK3CA
SCHEMBL2395156 0.73 CDK2 (0.59) MEN1KMT2APIK3CDPIK3CGPIK3CA
SCHEMBL2398032 0.71 PIK3CD (0.47) MEN1KMT2APIK3CDPIK3CGPIK3CA
SCHEMBL6276191 0.71 CDK2 (0.41) MEN1KMT2APIK3CDPIK3CGPIK3CA
SCHEMBL2394578 0.71 MEN1 (0.55) MEN1KMT2APIK3CDPIK3CGPIK3CA
SCHEMBL2395275 0.69 PIK3CD (0.62) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB

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
EP-1608647-A1 5-PHENYLTHIAZOLE DERIVATIVES AND THEIR USE AS P13 KINASE INHIBITORS Novartis AG (CH) 2005-12-28 EP disclosed
WO-2004078754-A1 5-PHENYLTHIAZOLE DERIVATIVES AND THEIR USE AS P13 KINASE INHIBITORS NOVARTIS AG (CH) 2004-09-16 WO disclosed