SCHEMBL3608085

SCHEMBL3608085

CC(C)S(=O)(=O)C(C)(C)c1cc(N2CCOC[C@@H]2C)nc(-c2ccc(NC(=O)NCCO)cc2)n1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 15/20 0.73
PIK3CD O00329 11/20 0.73
MTOR P42345 11/20 0.70
PIK3CB P42338 1/20 0.55
PIK3CG P48736 1/20 0.55
KCNH2 Q12809 2/20 0.48
RICTOR Q6R327 1/20 0.48
RPTOR Q8N122 1/20 0.48
MAPKAP1 Q9BPZ7 1/20 0.48
MLST8 Q9BVC4 1/20 0.48

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
SCHEMBL3603120 0.95 PIK3CA (0.71) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL3605923 0.94 PIK3CA (0.75) PIK3CAPIK3CDMTORKCNH2RICTOR
SCHEMBL3604473 0.92 PIK3CA (0.75) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL3608952 0.92 PIK3CA (0.85) PIK3CAPIK3CDMTORKCNH2
SCHEMBL3608924 0.92 PIK3CA (0.85) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL3598932 0.92 PIK3CA (0.71) PIK3CAPIK3CDMTORPIK3CG
SCHEMBL3598474 0.92 PIK3CA (0.74) PIK3CAPIK3CDMTORKCNH2
SCHEMBL3597508 0.92 PIK3CA (0.76) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL3598318 0.91 PIK3CA (0.73) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL3592254 0.90 PIK3CA (0.70) PIK3CAPIK3CDMTORPIK3CBPIK3CG

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 8 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

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 20/4885PIK3CD 19/4885MTOR 3/4885

“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.