SCHEMBL4322329

SCHEMBL4322329

CNC(=O)Nc1ccc2c(c1)C(=O)/C(=C/c1c[nH]c3c(CN4CCN(C)CC4)cc(OC)cc13)O2

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 14/20 0.60
MTOR P42345 13/20 0.51
ACHE P22303 3/20 0.43
PIK3CG P48736 2/20 0.41
PIK3CD O00329 1/20 0.41
PIK3CB P42338 1/20 0.41
PIM1 P11309 1/20 0.40
MAPK1 P28482 1/20 0.39
SRC P12931 1/20 0.37

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
SCHEMBL1429361 1.00 PIK3CA (0.60) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL1428746 0.93 PIK3CA (0.53) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL4315232 0.93 PIK3CA (0.53) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL4320766 0.92 PIK3CA (0.58) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL1428802 0.92 PIK3CA (0.58) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL4319556 0.89 PIK3CA (0.58) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL4319551 0.89 PIK3CA (0.58) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL4325623 0.82 PIK3CA (0.52) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL1428688 0.82 PIK3CA (0.52) PIK3CAMTORACHEPIK3CGPIK3CD
SCHEMBL1428686 0.82 PIK3CA (0.52) PIK3CAMTORACHEPIK3CGPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090311217-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-12-17 US claimed
US-20090311217-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-12-17 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-20090311217-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES MTOR, RICTOR, PDPK1 PIK3CA 4/4885MTOR 1/4885ACHE 4203/4885

“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.