SCHEMBL3602214

SCHEMBL3602214

CNC(=O)Nc1ccc(-c2nc(N3CCOCC3)cc(C(C)(C)S(C)(=O)=O)n2)cc1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 15/20 0.63
MTOR P42345 13/20 0.63
PIK3CG P48736 7/20 0.63
PIK3CD O00329 8/20 0.63
ATR Q13535 1/20 0.51

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
SCHEMBL13257087 0.92 PIK3CA (0.63) PIK3CAMTORPIK3CGPIK3CDATR
SCHEMBL3603932 0.90 PIK3CA (0.61) PIK3CAMTORPIK3CGPIK3CDATR
SCHEMBL3602666 0.90 PIK3CA (0.77) PIK3CAMTORPIK3CGPIK3CD
SCHEMBL3596872 0.89 PIK3CA (0.62) PIK3CAMTORPIK3CGPIK3CDATR
SCHEMBL8213908 0.87 PIK3CA (0.57) PIK3CAMTORPIK3CGPIK3CDATR
SCHEMBL3602819 0.87 PIK3CA (0.83) PIK3CAMTORPIK3CGPIK3CD
SCHEMBL3609044 0.86 PIK3CA (0.63) PIK3CAMTORPIK3CGPIK3CD
SCHEMBL3592954 0.86 PIK3CA (0.63) PIK3CAMTORPIK3CGPIK3CD
SCHEMBL3600812 0.86 PIK3CA (0.58) PIK3CAMTORPIK3CGPIK3CDATR
SCHEMBL4262466 0.83 PIK3CA (0.53) PIK3CAMTORPIK3CGPIK3CDATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057140-B1 MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2012-08-08 EP claimed
EP-2057140-B1 MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2012-08-08 EP disclosed
US-7750003-B2 Compounds-943 ASTRAZENECA AB (SE) 2010-07-06 US disclosed
US-7750003-B2 Compounds-943 ASTRAZENECA AB (SE) 2010-07-06 US disclosed
US-7750003-B2 Compounds-943 ASTRAZENECA AB (SE) 2010-07-06 US disclosed
US-20080171743-A1 Transcutaneous immunostimulation ASTRAZENECA AB (SE) 2008-07-17 US disclosed
US-20080171743-A1 Transcutaneous immunostimulation ASTRAZENECA AB (SE) 2008-07-17 US disclosed
US-20080171743-A1 Transcutaneous immunostimulation ASTRAZENECA AB (SE) 2008-07-17 US disclosed
WO-2008023159-A1 MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2008-02-28 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-20080171743-A1 Transcutaneous immunostimulation NFATC1, TLR9, MTOR PIK3CA 20/4885MTOR 3/4885PIK3CG 44/4885

“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.