SCHEMBL15747766

SCHEMBL15747766

CC(C)(C#N)c1ccc(-n2c(=O)[nH]c3cnc4ccc(Cl)nc4c32)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 19/20 0.68
▸ MTOR P42345 18/20 0.68
▸ PIK3CD O00329 6/20 0.46
▸ PIK3CG P48736 4/20 0.46
▸ PIK3CB P42338 3/20 0.42
▸ PRKDC P78527 2/20 0.41
▸ ATM Q13315 2/20 0.41
▸ ATR Q13535 2/20 0.41
▸ PIK3C2A O00443 1/20 0.41
▸ PIK3C2B O00750 1/20 0.41
▸ CHEK1 O14757 1/20 0.41
▸ ABCB11 O95342 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ MET P08581 1/20 0.41
▸ PIK3R1 P27986 1/20 0.41
▸ LTK P29376 1/20 0.41
▸ CDK7 P50613 1/20 0.41
▸ NEK2 P51955 1/20 0.41
▸ JAK3 P52333 1/20 0.41
▸ LIMK1 P53667 1/20 0.41

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
SCHEMBL31439304 1.00 PIK3CA (0.68) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL15615901 0.89 PIK3CA (0.56) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL18174513 0.83 PIK3CA (0.50) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL2281822 0.83 MTOR (0.79) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL1072362 0.82 PIK3CA (0.56) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL31439311 0.82 PIK3CA (0.70) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL15747768 0.82 PIK3CA (0.70) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL27846629 0.82 PIK3CA (0.54) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL2281788 0.81 PIK3CA (1.00) PIK3CAMTORPIK3CDPIK3CGPIK3CB
SCHEMBL2285699 0.81 PIK3CA (1.00) PIK3CAMTORPIK3CDPIK3CG

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-2014079364-A1 IMIDAZOLONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF 北京富龙康泰生物技术有限公司 (CN) 2014-05-30 — — WO disclosed
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