SCHEMBL3097540

SCHEMBL3097540

Cc1ncc(-c2ccc3ncc(-c4cnn(C)c4)nc3c2)cc1NS(=O)(=O)c1ccc(F)cc1F

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 14/20 0.55
PIK3CA P42336 4/20 0.49
MTOR P42345 1/20 0.49
PI4KA P42356 1/20 0.47
PIK3CG P48736 1/20 0.47
FGFR3 P22607 1/20 0.45
KDR P35968 1/20 0.45

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
SCHEMBL3086327 0.89 PIK3CG (0.60) PIK3C3PIK3CAMTORPI4KAPIK3CG
SCHEMBL3090038 0.86 PIK3CB (0.54) PIK3CA
SCHEMBL3095495 0.81 FGFR3 (0.51) PIK3C3PIK3CAMTORFGFR3KDR
SCHEMBL3087878 0.81 PIK3CA (0.56) PIK3C3PIK3CAMTORPIK3CG
SCHEMBL3088485 0.81 PRF1 (0.45) PIK3CAFGFR3KDR
SCHEMBL3086524 0.81 PRF1 (0.48) PIK3CAFGFR3KDR
SCHEMBL3092923 0.78 FGFR3 (0.48) PIK3CAFGFR3KDR
SCHEMBL3084748 0.77 PIK3CA (0.53) PIK3CAFGFR3KDR
SCHEMBL3079721 0.75 PIK3CA (0.60) PIK3CAPIK3CG
SCHEMBL3073351 0.75 PIK3CA (0.54) PIK3C3PIK3CAMTORPIK3CGFGFR3

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
US-20100234386-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-09-16 US disclosed
US-20100234386-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-09-16 US disclosed
EP-2150255-A1 QUINOXALINE DERIVATIVES AS P13 KINASE INHIBITORS Smithkline Beecham Corporation (US) 2010-02-10 EP disclosed
US-7592342-B2 Quinoxaline derivatives as PI3 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-09-22 US disclosed
US-7592342-B2 Quinoxaline derivatives as PI3 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-09-22 US disclosed
US-20080293706-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS GLAXOSMITHKLINE LLC 2008-11-27 US disclosed
US-20080293706-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS GLAXOSMITHKLINE LLC 2008-11-27 US disclosed
WO-2008141065-A1 QUINOXALINE DERIVATIVES AS P13 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-11-20 WO 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 (2 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-20080293706-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS PIP5K1A, PIK3CB, PIK3CG PIK3C3 28/4885PIK3CA 8/4885MTOR 92/4885
US-20100234386-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS PIP5K1A, PIK3CB, PIK3CG PIK3C3 28/4885PIK3CA 8/4885MTOR 92/4885

“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.