SCHEMBL4327240

SCHEMBL4327240

COc1ccc2c(c1)c(C=C1Oc3ccc(CNC(N)=O)cc3C1=O)c(-c1c(C)nn(C)c1C)n2CCN1CCNCC1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 18/20 0.48
MTOR P42345 18/20 0.48
PIK3CG P48736 10/20 0.46
PIK3CD O00329 1/20 0.40
PIK3CB P42338 1/20 0.40
CNR2 P34972 1/20 0.39

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
SCHEMBL4330181 0.94 PIK3CA (0.53) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL4318705 0.89 PIK3CA (0.51) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL4315819 0.89 PIK3CA (0.52) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL4328358 0.87 PIK3CA (0.48) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL4314955 0.86 PIK3CA (0.47) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL4323424 0.86 PIK3CA (0.51) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL1428644 0.86 PIK3CA (0.65) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL1429059 0.86 PIK3CA (0.65) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL4321631 0.85 PIK3CA (0.51) PIK3CAMTORPIK3CGPIK3CDPIK3CB
SCHEMBL1429277 0.80 PIK3CA (0.64) PIK3CAMTORPIK3CGPIK3CDPIK3CB

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-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 1/4885PIK3CG 8/4885

“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.