Sugi Predict

Sugi Predict / Compounds / SCHEMBL7876955

SCHEMBL7876955

SCHEMBL7876955

Bc1ccc2ncc3c(c2c1)n(-c1ccc(N2CC[C@H](O)C2)nc1C)c(=O)n3C

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 11/20 0.44
▸ MTOR P42345 10/20 0.44
▸ ATR Q13535 6/20 0.44
▸ PIK3CA P42336 6/20 0.44
▸ PIK3CD O00329 2/20 0.39
▸ PIK3CB P42338 2/20 0.39
▸ PIK3CG P48736 2/20 0.39
▸ METAP2 P50579 2/20 0.37

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
SCHEMBL7878799 1.00 ATM (0.44) ATMMTORATRPIK3CAPIK3CD
SCHEMBL3515818 0.90 ATM (0.44) ATMMTORATRPIK3CAPIK3CD
SCHEMBL3515975 0.90 ATM (0.44) ATMMTORATRPIK3CAPIK3CD
SCHEMBL3516026 0.90 ATM (0.44) ATMMTORATRPIK3CAPIK3CD
SCHEMBL7878044 0.86 MTOR (0.43) ATMMTORATRPIK3CAPIK3CD
SCHEMBL7874775 0.86 MTOR (0.43) ATMMTORATRPIK3CAPIK3CD
SCHEMBL2067655 0.85 ATM (0.49) ATMMTORATRPIK3CAPIK3CD
SCHEMBL2068075 0.85 ATM (0.49) ATMMTORATRPIK3CAPIK3CD
SCHEMBL2068161 0.85 ATM (0.49) ATMMTORATRPIK3CAPIK3CD
SCHEMBL2068931 0.83 ATM (0.48) ATMMTORATRPIK3CAPIK3CD

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-2010139747-A1 1H-IMIDAZO[4, 5-c]QUINOLINONE COMPOUNDS, USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2010-12-09 — — WO disclosed