SCHEMBL2927119

SCHEMBL2927119

CC(=O)Nc1nc2ccc(-c3cnc(Cl)c(NS(=O)(=O)c4cccc(OC(F)F)c4)c3)nn2c1-c1ccncc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 11/20 0.48
PIK3CA P42336 10/20 0.48
MTOR P42345 8/20 0.48
PIK3CD O00329 3/20 0.48
PIK3CG P48736 3/20 0.48
PIK3CB P42338 2/20 0.48
RIPK1 Q13546 2/20 0.40
PIK3C3 Q8NEB9 1/20 0.40
AKT2 P31751 1/20 0.40
AKT3 Q9Y243 1/20 0.40
FYN P06241 2/20 0.38

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
SCHEMBL2923077 0.93 PIK3CA (0.47) AKT1PIK3CAMTORPIK3CDPIK3CG
SCHEMBL2923806 0.93 PIK3CA (0.47) AKT1PIK3CAMTORPIK3CDPIK3CG
SCHEMBL2927303 0.89 AKT1 (0.51) AKT1PIK3CAMTORPIK3CDPIK3CG
SCHEMBL3450911 0.88 PIK3CA (0.46) AKT1PIK3CAMTORPIK3CDPIK3CG
SCHEMBL2951570 0.86 AKT1 (0.45) AKT1PIK3CAMTORPIK3CDPIK3CG
SCHEMBL2917989 0.86 PIK3CA (0.65) AKT1PIK3CAMTORPIK3CDPIK3CG
Trifluoroacetic Acid SCHEMBL2927152 0.85 PIK3CA (0.44) AKT1PIK3CAMTORPIK3CDPIK3CG
SCHEMBL2926918 0.83 PIK3CA (0.53) AKT1PIK3CAMTORPIK3CDPIK3CG
SCHEMBL2957127 0.83 AKT1 (0.42) AKT1PIK3CAMTORPIK3CDPIK3CG
SCHEMBL2919450 0.81 PIK3CA (0.73) AKT1PIK3CAMTORPIK3CDPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820665-B2 Imidazopyridazine inhibitors of PI3 kinase for cancer treatment AMGEN INC. (US) 2010-10-26 US claimed
EP-2231661-A1 INHIBITORS OF PI3 KINASE Amgen, Inc. (US) 2010-09-29 EP claimed
WO-2009085230-A1 INHIBITORS OF PI3 KINASE AMGEN INC. (US) 2009-07-09 WO claimed
US-20090163489-A1 Inhibitors of PI3 kinase AMGEN INC. 2009-06-25 US claimed
EP-3024456-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE Update Pharma Inc. (US) 2016-06-01 EP disclosed
EP-3024457-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE Update Pharma Inc. (US) 2016-06-01 EP disclosed
WO-2015013579-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE UPDATE PHARMA INC. (US) 2015-01-29 WO disclosed
WO-2015013581-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE UPDATE PHARMA INC. (US) 2015-01-29 WO disclosed
US-7820665-B2 Imidazopyridazine inhibitors of PI3 kinase for cancer treatment AMGEN INC. (US) 2010-10-26 US disclosed
US-7820665-B2 Imidazopyridazine inhibitors of PI3 kinase for cancer treatment AMGEN INC. (US) 2010-10-26 US disclosed
US-7820665-B2 Imidazopyridazine inhibitors of PI3 kinase for cancer treatment AMGEN INC. (US) 2010-10-26 US disclosed
EP-2231661-A1 INHIBITORS OF PI3 KINASE Amgen, Inc. (US) 2010-09-29 EP disclosed
WO-2009085230-A1 INHIBITORS OF PI3 KINASE AMGEN INC. (US) 2009-07-09 WO disclosed
US-20090163489-A1 Inhibitors of PI3 kinase AMGEN INC. 2009-06-25 US disclosed
US-20090163489-A1 Inhibitors of PI3 kinase AMGEN INC. 2009-06-25 US disclosed
US-20090163489-A1 Inhibitors of PI3 kinase AMGEN INC. 2009-06-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090163489-A1 Inhibitors of PI3 kinase PIK3CA, PIK3CD, PIK3CG AKT1 33/4885PIK3CA 1/4885MTOR 28/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.