SCHEMBL15747763

SCHEMBL15747763

Cn1c(=O)n(-c2ccc(C3CCN(C(=O)OCc4ccccc4)CC3)cc2)c2c3cc(Br)ccc3ncc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 9/20 0.42
▸ MTOR P42345 9/20 0.42
▸ ATM Q13315 4/20 0.41
▸ ATR Q13535 3/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ PIK3CD O00329 4/20 0.40
▸ PIK3CG P48736 4/20 0.40
▸ PIK3CB P42338 3/20 0.40
▸ JAK3 P52333 3/20 0.40
▸ JAK2 O60674 2/20 0.40
▸ JAK1 P23458 2/20 0.40
▸ TYK2 P29597 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ PIK3C2A O00443 2/20 0.39
▸ PIK3C2B O00750 2/20 0.39

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
SCHEMBL15747831 0.89 ADORA2A (0.47) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747730 0.88 MTOR (0.55) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747772 0.87 MTOR (0.55) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747812 0.86 MTOR (0.57) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747888 0.86 MTOR (0.43) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747811 0.86 ATM (0.52) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747851 0.85 MTOR (0.45) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747876 0.85 MTOR (0.45) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747814 0.85 ATM (0.43) PIK3CAMTORATMATRPIK3CD
SCHEMBL15747771 0.85 GRIN2B (0.42) PIK3CAMTORPDE4BJAK3JAK2

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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