SCHEMBL18948407

SCHEMBL18948407

COc1cc(-c2ccc3c(n2)[C@H](O)N(c2cnn(CC(F)(F)F)c2)C3=O)cnc1OC

nearest known ligand 0.83

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 18/20 0.83
▸ PRKDC P78527 1/20 0.83
▸ PIK3CD O00329 4/20 0.39
▸ PIK3CA P42336 4/20 0.39
▸ LRRK2 Q5S007 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
SCHEMBL10142608 1.00 PIK3CG (0.83) PIK3CGPRKDCPIK3CDPIK3CALRRK2
SCHEMBL18948408 1.00 PIK3CG (0.83) PIK3CGPRKDCPIK3CDPIK3CALRRK2
SCHEMBL10142650 0.91 PIK3CG (1.00) PIK3CGPRKDCPIK3CDPIK3CALRRK2
SCHEMBL10142647 0.91 PIK3CG (1.00) PIK3CGPRKDCPIK3CDPIK3CALRRK2
SCHEMBL612044 0.91 PIK3CG (1.00) PIK3CGPRKDCPIK3CDPIK3CALRRK2
SCHEMBL10142787 0.90 PIK3CG (0.83) PIK3CGPRKDCPIK3CDPIK3CAADORA2A
SCHEMBL612092 0.90 PIK3CG (0.83) PIK3CGPRKDCPIK3CDPIK3CAADORA2A
SCHEMBL10142763 0.90 PIK3CG (0.83) PIK3CGPRKDCPIK3CDPIK3CAADORA2A
SCHEMBL10142614 0.89 PIK3CG (0.82) PIK3CGPRKDCPIK3CDPIK3CALRRK2
SCHEMBL10142483 0.89 PIK3CG (0.82) PIK3CGPRKDCPIK3CDPIK3CALRRK2

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
US-9676759-B2 Isoindolinone inhibitors of phosphatidylinositol 3-kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2017-06-13 — — US disclosed
Send feedback