SCHEMBL16623165

SCHEMBL16623165

Cc1nc(N)nc(-c2cc(C3CCOCC3)cnc2Nc2cnc(Cl)c(N)c2)n1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 20/20 0.78
MTOR P42345 14/20 0.78

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
SCHEMBL168116 0.88 PIK3CA (1.00) PIK3CAMTOR
SCHEMBL16613052 0.85 PIK3CA (0.70) PIK3CAMTOR
SCHEMBL116875 0.82 PIK3CA (1.00) PIK3CAMTOR
SCHEMBL3100328 0.79 PIK3CA (1.00) PIK3CAMTOR
SCHEMBL168841 0.76 PIK3CA (0.62) PIK3CAMTOR
SCHEMBL116964 0.76 PIK3CA (1.00) PIK3CAMTOR
SCHEMBL114796 0.72 PIK3CA (1.00) PIK3CAMTOR
SCHEMBL13075488 0.71 PIK3CA (0.82) PIK3CAMTOR
SCHEMBL13075489 0.71 PIK3CA (0.82) PIK3CAMTOR
SCHEMBL13075424 0.71 PIK3CA (0.82) PIK3CAMTOR

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
EP-2424859-B1 INHIBITORS OF PI3 KINASE AND / OR MTOR AMGEN INC (US) 2015-04-08 EP disclosed