SCHEMBL753916

SCHEMBL753916

COCCOc1cnnc(Nc2cc(-c3c(Cl)nc4cccnn34)nc(C)n2)c1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 11/20 0.61
MTOR P42345 11/20 0.61
CDK2 P24941 1/20 0.33
MAPKAPK2 P49137 1/20 0.33
PDE4B Q07343 7/20 0.33
PDE4D Q08499 7/20 0.33
GSK3B P49841 1/20 0.32
PDE4A P27815 5/20 0.32
PDE4C Q08493 5/20 0.32

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
SCHEMBL755340 0.85 PIK3CA (0.54) PIK3CAMTORCDK2MAPKAPK2
SCHEMBL750322 0.85 PIK3CA (0.64) PIK3CAMTORCDK2MAPKAPK2
SCHEMBL752881 0.83 PIK3CA (0.60) PIK3CAMTORCDK2MAPKAPK2GSK3B
SCHEMBL11026828 0.82 PIK3CA (0.51) PIK3CAMTORCDK2MAPKAPK2
SCHEMBL755032 0.82 PIK3CA (0.58) PIK3CAMTORCDK2MAPKAPK2
SCHEMBL11026838 0.81 PIK3CA (0.51) PIK3CAMTORCDK2MAPKAPK2
SCHEMBL11030417 0.80 PIK3CA (0.56) PIK3CAMTORCDK2MAPKAPK2PDE4B
SCHEMBL11025368 0.75 PIK3CA (0.75) PIK3CAMTOR
SCHEMBL753636 0.73 PIK3CA (0.61) PIK3CAMTOR
SCHEMBL2773478 0.72 PIK3CA (0.47) PIK3CAMTOR

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-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP disclosed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US disclosed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP disclosed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 WO 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 21/4885CDK2 189/4885

“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.