SCHEMBL2918526

SCHEMBL2918526

CC(=O)Nc1cn2nc(-c3cnc(Cl)c(NS(C)(=O)=O)c3)ccc2n1

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 9/20 0.76
AKT1 P31749 4/20 0.76
MTOR P42345 3/20 0.76
PIK3CB P42338 2/20 0.76
PIK3CD O00329 1/20 0.76
PIK3CG P48736 1/20 0.76
AKT2 P31751 1/20 0.74
AKT3 Q9Y243 1/20 0.74
RIPK1 Q13546 11/20 0.57

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
SCHEMBL2924341 0.91 PIK3CA (0.74) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL3251576 0.87 PIK3CA (0.86) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL2927504 0.87 PIK3CA (1.00) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL13784022 0.86 PIK3CA (0.83) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL2925093 0.85 PIK3CA (0.82) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL2926894 0.85 PIK3CA (0.82) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL2947075 0.85 PIK3CA (1.00) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL2916784 0.84 PIK3CA (0.70) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL2921077 0.84 PIK3CA (0.83) PIK3CAAKT1MTORPIK3CBPIK3CD
SCHEMBL2923084 0.84 PIK3CA (0.81) PIK3CAAKT1MTORPIK3CBPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
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 PIK3CA 1/4885AKT1 33/4885MTOR 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.