SCHEMBL19446175

SCHEMBL19446175

CCOc1ncc(-c2ccc3c(n2)CN(c2cnn(CC(F)(F)F)c2)C3=O)cc1OC

nearest known ligand 0.89

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 18/20 0.89
▸ PRKDC P78527 1/20 0.60
▸ PIK3CD O00329 3/20 0.36
▸ PIK3CA P42336 3/20 0.36
▸ TTK P33981 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA2B P29275 1/20 0.34

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
SCHEMBL611166 0.94 PIK3CG (1.00) PIK3CGPRKDCPIK3CDPIK3CA
SCHEMBL10174790 0.91 PIK3CG (0.90) PIK3CGPRKDCPIK3CDPIK3CA
SCHEMBL10142804 0.91 PIK3CG (0.86) PIK3CGPRKDCPIK3CDPIK3CA
SCHEMBL10174592 0.90 PIK3CG (0.79) PIK3CGPRKDCPIK3CDPIK3CA
SCHEMBL10174445 0.87 PIK3CG (0.86) PIK3CGPRKDCPIK3CDPIK3CA
SCHEMBL10142313 0.87 PIK3CG (0.89) PIK3CGPRKDCPIK3CDPIK3CA
SCHEMBL10174656 0.86 PIK3CG (0.80) PIK3CGPRKDCPIK3CDPIK3CA
SCHEMBL10142454 0.86 PIK3CG (1.00) PIK3CGPRKDCPIK3CDPIK3CA
SCHEMBL10142949 0.85 PIK3CG (0.81) PIK3CGPRKDCPIK3CA
SCHEMBL10174594 0.85 PIK3CG (0.71) PIK3CGPRKDCPIK3CDPIK3CA

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-2516417-B1 ISOINDOLINONE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMA (US) 2017-10-11 — — EP disclosed
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