SCHEMBL301188

SCHEMBL301188

NC(=O)c1nc(-c2cccc(O)c2)nc2c1[nH]c(=O)n2-c1ccc(F)cc1F

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.78
PIK3CB P42338 12/20 0.78
PIK3CG P48736 12/20 0.78
PIK3CA P42336 11/20 0.78
CSNK2A1 P68400 4/20 0.62
MAPT P10636 1/20 0.58
KIF5C O60282 1/20 0.54
KIF11 P52732 1/20 0.54
KIF5A Q12840 1/20 0.54
KDM4E B2RXH2 1/20 0.51
GLA P06280 1/20 0.51

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
SCHEMBL301171 0.91 PIK3CD (0.75) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300834 0.91 PIK3CD (0.69) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300955 0.89 PIK3CD (0.72) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300918 0.88 PIK3CD (0.66) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL27796448 0.88 PIK3CD (0.71) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300865 0.87 PIK3CD (0.84) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300970 0.86 PIK3CD (0.77) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300915 0.85 PIK3CD (0.72) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300830 0.85 PIK3CD (0.66) PIK3CDPIK3CBPIK3CGPIK3CACSNK2A1
SCHEMBL300925 0.84 PIK3CD (0.70) 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