SCHEMBL9953258

SCHEMBL9953258

[CH2]C(c1cc(Cl)c(C)c(C2CNC(=O)C2)c1OC)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.54
PDE4A P27815 5/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
KCNH2 Q12809 1/20 0.36

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
SCHEMBL9929221 0.84 PIK3CD (0.60) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL9928886 0.80 PIK3CD (0.50) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL9929718 0.80 PIK3CD (0.56) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL9951939 0.78 PIK3CD (0.47) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL9953256 0.78 PIK3CD (0.45) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL9953002 0.77 PIK3CD (0.50) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL9952929 0.74 PIK3CD (0.48) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL28952539 0.73 PIK3CD (0.62) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL30276021 0.73 PIK3CD (0.62) PIK3CDPDE4APDE4BPDE4CPDE4D
SCHEMBL9928709 0.71 PIK3CD (0.55) PIK3CDKCNH2

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-2655374-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS Incyte Corporation (US) 2013-10-30 EP disclosed
WO-2012087881-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2012-06-28 WO disclosed