SCHEMBL15747784

SCHEMBL15747784

Cn1c(=O)n(-c2ccc(C3CCNCC3)cc2)c2c3cc(-c4cnn(-c5ccccc5)c4)ccc3ncc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 19/20 0.61
▸ PIK3CA P42336 10/20 0.53
▸ PIK3CD O00329 5/20 0.53
▸ PIK3CB P42338 5/20 0.53
▸ PIK3CG P48736 5/20 0.53
▸ PIK3C2A O00443 2/20 0.48
▸ PIK3C2B O00750 2/20 0.48
▸ ATM Q13315 5/20 0.47
▸ ATR Q13535 5/20 0.47
▸ PIK3C3 Q8NEB9 2/20 0.46
▸ RPTOR Q8N122 2/20 0.46
▸ MLST8 Q9BVC4 2/20 0.46
▸ ACVR1 Q04771 2/20 0.46
▸ CHEK1 O14757 1/20 0.46
▸ ABCB11 O95342 1/20 0.46
▸ CSF1R P07333 1/20 0.46
▸ MET P08581 1/20 0.46
▸ PIK3R1 P27986 1/20 0.46
▸ LTK P29376 1/20 0.46
▸ CDK7 P50613 1/20 0.46

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
SCHEMBL15747790 0.86 MTOR (0.60) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747838 0.85 MTOR (0.59) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747806 0.85 MTOR (0.65) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747791 0.84 MTOR (0.61) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747812 0.83 MTOR (0.57) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747875 0.81 MTOR (0.51) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747845 0.80 ATM (0.54) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747819 0.79 MTOR (0.61) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747891 0.79 MTOR (0.51) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747781 0.78 ATM (0.59) MTORPIK3CAPIK3CDPIK3CBPIK3CG

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
Send feedback