SCHEMBL14385586

SCHEMBL14385586

Cc1nc(NC(=O)CC[C@H](NCC(C)C)C(=O)O)sc1-c1ccc(Cl)c(S(C)(=O)=O)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 12/20 0.52
▸ PIK3CG P48736 12/20 0.52
▸ PIK3CA P42336 8/20 0.52
▸ PIK3CB P42338 7/20 0.52
▸ PI4KB Q9UBF8 9/20 0.49
▸ PIK3C3 Q8NEB9 3/20 0.49
▸ PIK3C2A O00443 1/20 0.49
▸ PIK3C2B O00750 1/20 0.49
▸ PI4KA P42356 1/20 0.49
▸ PRKDC P78527 1/20 0.49

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
SCHEMBL14385621 0.88 PIK3CD (0.58) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL21301610 0.88 PIK3CD (0.56) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL14385599 0.87 PIK3CD (0.49) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL3181259 0.87 PIK3CD (0.50) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL14385619 0.85 PIK3CD (0.52) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL4222907 0.85 PIK3CD (0.56) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL4222887 0.85 PIK3CD (0.56) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL3177533 0.85 PIK3CD (0.50) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL3177545 0.85 PIK3CD (0.50) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL4232065 0.85 PIK3CD (0.49) 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 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
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