SCHEMBL11028952

SCHEMBL11028952

Cc1nc(N)cc(-c2c(Nc3ccn(C(=O)Nc4ccc(C(F)(F)F)cc4Cl)n3)nc3cccnn23)n1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 14/20 0.51
MTOR P42345 14/20 0.51
NTRK1 P04629 1/20 0.36
MAPK14 Q16539 2/20 0.35
MAPK13 O15264 1/20 0.34
MAPK12 P53778 1/20 0.34
MAPK11 Q15759 1/20 0.34
TP53 P04637 1/20 0.33
PDE4B Q07343 2/20 0.32
PDE4D Q08499 2/20 0.32
PDE4A P27815 1/20 0.32
PDE4C Q08493 1/20 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
SCHEMBL11029785 0.94 PIK3CA (0.51) PIK3CAMTORMAPK14MAPK13MAPK12
SCHEMBL11028499 0.87 PIK3CA (0.53) PIK3CAMTORTP53
SCHEMBL11029301 0.86 MTOR (0.54) PIK3CAMTORMAPK14PDE4BPDE4D
SCHEMBL11030527 0.85 MTOR (0.51) PIK3CAMTORMAPK14MAPK13MAPK12
SCHEMBL11027586 0.84 MTOR (0.57) PIK3CAMTORMAPK14MAPK13MAPK12
SCHEMBL11031381 0.84 MTOR (0.56) PIK3CAMTORPDE4BPDE4DPDE4A
SCHEMBL11025352 0.83 PIK3CA (0.54) PIK3CAMTORMAPK14MAPK13MAPK12
SCHEMBL751618 0.83 MTOR (0.58) PIK3CAMTORMAPK14MAPK13MAPK12
SCHEMBL2785665 0.81 MTOR (0.64) PIK3CAMTORMAPK14MAPK13MAPK12
SCHEMBL2785390 0.81 MTOR (0.61) PIK3CAMTORMAPK14MAPK13MAPK12

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 3 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-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 21/4885NTRK1 939/4885

“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.