SCHEMBL3095673

SCHEMBL3095673

Cn1cc(-c2cnc3ccc(-c4cncc(NS(=O)(=O)c5ccc(-c6ccc(Cl)cc6)cc5)c4)cc3n2)cn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 6/20 0.56
KDR P35968 6/20 0.56
PIK3CA P42336 3/20 0.49
PIK3CD O00329 2/20 0.49
PIK3CG P48736 2/20 0.49
PRF1 P14222 1/20 0.45
ALPL P05186 3/20 0.43
FGFR1 P11362 5/20 0.43
FGFR2 P21802 4/20 0.43
FGFR4 P22455 4/20 0.43
EGFR P00533 1/20 0.42
FLT3 P36888 1/20 0.42
PIK3CB P42338 1/20 0.41
BRD4 O60885 1/20 0.41
LRRK2 Q5S007 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
DRD2 P14416 1/20 0.41

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
SCHEMBL3096681 0.99 FGFR3 (0.57) FGFR3KDRPIK3CAPIK3CDPIK3CG
SCHEMBL3090646 0.91 PIK3CB (0.52) FGFR3KDRPIK3CAPIK3CDPIK3CG
SCHEMBL3091107 0.91 LRRK2 (0.48) FGFR3KDRPIK3CAPIK3CDPIK3CG
SCHEMBL3093227 0.90 FGFR3 (0.48) FGFR3KDRPIK3CAPIK3CDPIK3CG
SCHEMBL3073351 0.90 PIK3CA (0.54) FGFR3KDRPIK3CAPIK3CDPIK3CG
SCHEMBL3094941 0.90 PIK3CA (0.50) FGFR3KDRPIK3CAPIK3CDPIK3CG
SCHEMBL3074232 0.90 FGFR3 (0.54) FGFR3KDRPIK3CAPIK3CDPIK3CG
SCHEMBL3090021 0.89 PIK3CB (0.54) FGFR3KDRPIK3CAPRF1ALPL
SCHEMBL3093314 0.88 FGFR3 (0.57) FGFR3KDRALPLMET
SCHEMBL3091883 0.88 ALPL (0.46) FGFR3KDRPIK3CAPRF1ALPL

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 11 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
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-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
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 FGFR3 2690/4885KDR 1697/4885PIK3CA 8/4885
US-20100234386-A1 QUINOXALINE DERIVATIVES AS PI3 KINASE INHIBITORS PIP5K1A, PIK3CB, PIK3CG FGFR3 2690/4885KDR 1697/4885PIK3CA 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.