SCHEMBL14725942

SCHEMBL14725942

CS(=O)(=O)N1CCN(Cc2nc3c(N4CCOCC4)nc(Br)cn3n2)CC1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 20/20 0.68
PIK3CA P42336 20/20 0.68
MTOR P42345 8/20 0.68
PIK3CD O00329 8/20 0.68
PIK3CB P42338 7/20 0.68
PIK3CG P48736 7/20 0.68

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
SCHEMBL10100405 0.81 PIK3R1 (0.70) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL14725945 0.81 PIK3R1 (1.00) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL14725982 0.80 PIK3CA (0.52) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL14725944 0.76 PIK3CA (0.75) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL14725934 0.76 PIK3R1 (0.39) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL14725940 0.76 PIK3CA (0.39) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL18599126 0.76 PIK3R1 (0.64) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL14725986 0.76 PIK3R1 (0.66) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL17834982 0.73 PIK3CA (0.68) PIK3R1PIK3CAMTORPIK3CDPIK3CB
SCHEMBL29959501 0.73 PIK3CA (0.68) PIK3R1PIK3CAMTORPIK3CDPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9073927-B2 Inhibitors of PI3 kinase FUNDACION CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III (ES) 2015-07-07 US disclosed
US-9073927-B2 Inhibitors of PI3 kinase FUNDACION CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III (ES) 2015-07-07 US disclosed
US-20130053371-A1 INHIBITORS OF PI3 KINASE CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) 2013-02-28 US disclosed
US-20130053371-A1 INHIBITORS OF PI3 KINASE CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) 2013-02-28 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-20130053371-A1 INHIBITORS OF PI3 KINASE PIK3CA, MTOR, PIK3C2A PIK3R1 28/4885PIK3CA 1/4885MTOR 2/4885

“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.