SCHEMBL4314959

SCHEMBL4314959

Cc1c(/C=C2/Oc3cc(O)cc(O)c3C2=O)c2cc(Cl)ccc2n1C

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 16/20 0.75
MTOR P42345 16/20 0.75
PIK3CG P48736 14/20 0.75
ABCC2 Q92887 4/20 0.57

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
SCHEMBL1429309 1.00 PIK3CA (0.75) PIK3CAMTORPIK3CGABCC2
SCHEMBL1429374 0.88 PIK3CA (0.75) PIK3CAMTORPIK3CGABCC2
SCHEMBL4333417 0.88 PIK3CA (0.75) PIK3CAMTORPIK3CGABCC2
SCHEMBL1427661 0.83 ABCC2 (0.64) PIK3CAMTORPIK3CGABCC2
SCHEMBL4327314 0.83 ABCC2 (0.64) PIK3CAMTORPIK3CGABCC2
SCHEMBL1428613 0.80 PIK3CA (0.73) PIK3CAMTORPIK3CGABCC2
SCHEMBL4319759 0.80 PIK3CA (0.73) PIK3CAMTORPIK3CGABCC2
SCHEMBL4322288 0.79 PIK3CA (0.85) PIK3CAMTORPIK3CGABCC2
SCHEMBL4322291 0.79 PIK3CA (0.85) PIK3CAMTORPIK3CGABCC2
SCHEMBL4318748 0.78 PIK3CA (0.78) PIK3CAMTORPIK3CG

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 1/4885PIK3CG 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.