SCHEMBL11029630

SCHEMBL11029630

COCCNc1ccc2nc(Nc3cccc4[nH]ncc34)c(-c3cc(N)nc(C)n3)n2n1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 17/20 0.53
PIK3CB P42338 5/20 0.51
PIK3CG P48736 5/20 0.51
PIK3CD O00329 4/20 0.51
MTOR P42345 4/20 0.47
SYK P43405 1/20 0.38
RET P07949 1/20 0.36
KIF5B P33176 1/20 0.36
NCF1 P14598 1/20 0.35

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
SCHEMBL164000 0.70 PIK3CA (1.00) PIK3CAPIK3CBPIK3CGPIK3CDMTOR
SCHEMBL165181 0.69 PIK3CA (1.00) PIK3CAPIK3CBPIK3CGPIK3CDMTOR
SCHEMBL168583 0.68 PIK3CA (1.00) PIK3CAPIK3CBPIK3CGPIK3CDMTOR
SCHEMBL2790651 0.67 PIK3CA (0.42) PIK3CAPIK3CBPIK3CGPIK3CDMTOR
SCHEMBL11030218 0.67 PIK3CA (0.57) PIK3CAMTOR
SCHEMBL168179 0.65 PIK3CA (1.00) PIK3CAPIK3CBPIK3CGPIK3CDMTOR
SCHEMBL2789837 0.65 PIK3CA (1.00) PIK3CAPIK3CBPIK3CGPIK3CDMTOR
SCHEMBL2789156 0.64 PIK3CA (0.67) PIK3CAPIK3CBPIK3CGPIK3CDMTOR
SCHEMBL752861 0.64 PIK3CA (0.55) PIK3CAPIK3CBPIK3CGPIK3CDMTOR
SCHEMBL755704 0.64 PIK3CA (0.53) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD PIK3CA 1/4885PIK3CB 8/4885PIK3CG 7/4885

“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.