SCHEMBL13257542

SCHEMBL13257542

CN(C)c1cc(C(=O)O)nc2c(-c3cccc(N)c3)nc(N3CCOCC3)nc12

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 20/20 0.77

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
SCHEMBL13257322 0.87 PIK3CA (1.00) PIK3CA
SCHEMBL13257537 0.86 PIK3CA (1.00) PIK3CA
SCHEMBL13257528 0.86 PIK3CA (0.81) PIK3CA
SCHEMBL13257306 0.85 PIK3CA (1.00) PIK3CA
SCHEMBL13257328 0.85 PIK3CA (1.00) PIK3CA
SCHEMBL13257274 0.81 PIK3CA (1.00) PIK3CA
SCHEMBL3711682 0.80 PIK3CA (1.00) PIK3CA
SCHEMBL13257509 0.80 PIK3CA (1.00) PIK3CA
SCHEMBL13257324 0.79 PIK3CA (1.00) PIK3CA
SCHEMBL13257382 0.79 PIK3CA (1.00) PIK3CA

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-2010091996-A1 2-MORPHOLINO-PYRIDO[3,2-D]PYRIMIDINES MERCK SERONO S.A. (CH) 2010-08-19 WO disclosed