SCHEMBL750340

SCHEMBL750340

CNC(=O)c1ccc(Nc2nc3ccccn3c2-c2cc(N)nc(C)n2)cn1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 16/20 0.58
MTOR P42345 13/20 0.58
XIAP P98170 1/20 0.40
BIRC2 Q13490 1/20 0.40
PIK3CB P42338 3/20 0.39
PIK3CD O00329 1/20 0.39
PIK3CG P48736 1/20 0.39
CCNE1 P24864 2/20 0.36
CDK2 P24941 2/20 0.36
CDK4 P11802 1/20 0.36

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
SCHEMBL755730 0.92 PIK3CA (0.57) PIK3CAMTORXIAPBIRC2CCNE1
SCHEMBL751575 0.91 PIK3CA (0.55) PIK3CAMTORXIAPBIRC2PIK3CB
SCHEMBL749741 0.91 PIK3CA (0.55) PIK3CAMTOR
SCHEMBL751576 0.89 PIK3CA (0.54) PIK3CAMTORPIK3CBPIK3CDPIK3CG
SCHEMBL752836 0.84 PIK3CA (0.57) PIK3CAMTORPIK3CBPIK3CDPIK3CG
SCHEMBL11028397 0.83 PIK3CA (0.59) PIK3CAMTORPIK3CBPIK3CDPIK3CG
SCHEMBL752570 0.81 PIK3CA (0.61) PIK3CAMTORPIK3CBCDK2CDK4
SCHEMBL2790005 0.81 PIK3CA (0.62) PIK3CAMTORPIK3CBCCNE1CDK2
SCHEMBL754042 0.80 MTOR (0.55) PIK3CAMTORPIK3CBCCNE1CDK2
SCHEMBL751149 0.80 PIK3CA (0.57) PIK3CAMTORPIK3CBPIK3CDPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US claimed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP claimed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 WO claimed
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD PIK3CA 1/4885MTOR 21/4885XIAP 575/4885

“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.