SCHEMBL4051247

SCHEMBL4051247

O=c1[nH]c2cnc(-c3cccc(O)c3)nc2n1-c1c(Cl)cccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 10/20 0.43
PIK3CB P42338 9/20 0.43
PIK3CG P48736 9/20 0.43
PIK3CA P42336 8/20 0.42
MAP3K11 Q16584 1/20 0.42
CSNK1D P48730 3/20 0.40
ADORA3 P0DMS8 1/20 0.40
GSK3B P49841 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 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
SCHEMBL4047579 0.85 PIK3CD (0.40) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11
SCHEMBL15206460 0.80 PIK3CA (0.45) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11
SCHEMBL15205609 0.79 PIK3CA (0.44) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11
SCHEMBL15205809 0.79 PIK3CD (0.50) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11
SCHEMBL29828750 0.79 PIK3CD (0.50) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11
SCHEMBL15206385 0.78 PIK3CD (0.41) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11
SCHEMBL29829004 0.78 PIK3CD (0.41) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11
SCHEMBL300847 0.77 PIK3CD (0.71) PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29829049 0.77 PIK3CD (0.40) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11
SCHEMBL15205774 0.77 PIK3CD (0.40) PIK3CDPIK3CBPIK3CGPIK3CAMAP3K11

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-2078018-A1 HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2009-07-15 EP disclosed
WO-2008051494-A1 HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2008-05-02 WO disclosed