SCHEMBL5509834

SCHEMBL5509834

Cc1nc(CC(N)=O)sc1-c1cnc(Cl)c(N)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 7/20 0.42
PIK3CB P42338 10/20 0.42
PIK3CA P42336 9/20 0.42
PIK3CD O00329 11/20 0.40
PIK3CG P48736 9/20 0.40
PIK3C3 Q8NEB9 1/20 0.38
PPARD Q03181 1/20 0.37

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
SCHEMBL17881196 0.79 PIK3CD (0.45) PIK3CBPIK3CAPIK3CDPIK3CG
SCHEMBL5508446 0.79 ATAD2 (0.39) GPR52PIK3CBPIK3CAPIK3CDPIK3CG
SCHEMBL924229 0.78 PIK3CB (0.67) PIK3CBPIK3CAPIK3CDPIK3CG
SCHEMBL48824 0.77 ALDH1A1 (0.46) GPR52PIK3CBPIK3CAPIK3CDPIK3CG
SCHEMBL924892 0.70 MEN1 (0.45) PIK3CBPIK3CAPIK3CDPIK3CGPIK3C3
SCHEMBL17881197 0.70 PIK3CD (0.49) PIK3CBPIK3CAPIK3CDPIK3CGPIK3C3
SCHEMBL17881231 0.69 PIK3CA (0.49) PIK3CBPIK3CAPIK3CDPIK3CGPIK3C3
SCHEMBL31543990 0.69 PIK3CG (0.46) GPR52PIK3CBPIK3CAPIK3CDPIK3CG
SCHEMBL17881217 0.69 PIK3CD (0.58) PIK3CBPIK3CAPIK3CDPIK3CGPIK3C3
SCHEMBL3638579 0.68 ALDH1A1 (0.54) GPR52

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-1841763-A1 5-HETEROARYL THIAZOLES AND THEIR USE AS PI3K INHIBITORS AstraZeneca AB (SE) 2007-10-10 EP disclosed
WO-2006051270-A1 5-HETEROARYL THIAZOLES AND THEIR USE AS P13K INHIBITORS ASTRAZENECA AB (SE) 2006-05-18 WO disclosed