SCHEMBL300833

SCHEMBL300833

NC(=O)c1nc(-c2cccc(O)c2)nc2c1[nH]c(=O)n2-c1cccc(C(F)(F)F)c1F

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.68
PIK3CB P42338 13/20 0.68
PIK3CG P48736 13/20 0.68
PIK3CA P42336 12/20 0.68
CSNK2A1 P68400 5/20 0.55
MAPT P10636 1/20 0.55

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
SCHEMBL301340 0.93 PIK3CD (0.68) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300915 0.88 PIK3CD (0.72) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL301171 0.87 PIK3CD (0.75) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300955 0.86 PIK3CD (0.72) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL301173 0.85 PIK3CD (0.65) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL30662742 0.85 PIK3CD (0.65) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300925 0.85 PIK3CD (0.70) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL28028899 0.83 PIK3CD (0.49) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300875 0.83 PIK3CD (0.67) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL301188 0.83 PIK3CD (0.78) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2078018-B1 HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARM LLC (US) 2012-03-14 EP claimed
CN-107976546-B Inhibition of phosphorylation of TOR kinase inhibitory Activity markers PRAS40, GSK 3-beta, or P70S6K1 西格诺药品有限公司 2020-10-27 CN disclosed
CN-110721186-A Treatment of prostate cancer with TOR kinase inhibitors 西格诺药品有限公司 2020-01-24 CN disclosed
CN-107157990-B Treatment of cancer with TOR kinase inhibitors 西格诺药品有限公司 2020-01-07 CN disclosed