SCHEMBL3114705

SCHEMBL3114705

O=S(=O)(Oc1ccc2ncc(F)c(-c3ccncc3)c2n1)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.35
PDE4C Q08493 3/20 0.35
PDE4D Q08499 3/20 0.35
RAF1 P04049 2/20 0.32
DYRK1A Q13627 2/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MAP4K4 O95819 1/20 0.31

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
SCHEMBL3118851 0.80 KCNH2 (0.42) PDE4APDE4CPDE4DCA1CA2
SCHEMBL23825277 0.79 PDE4A (0.34) PDE4APDE4CPDE4DCA1CA2
SCHEMBL3118699 0.79 DYRK1A (0.48) RAF1DYRK1A
SCHEMBL3121332 0.72 MAP4K4 (0.41) DYRK1AMAP4K4
SCHEMBL15884843 0.71 PDE4A (0.41) PDE4APDE4CPDE4DMAP4K4
SCHEMBL3124457 0.71 PDE4A (0.42) PDE4APDE4CPDE4DCA1CA2
SCHEMBL30625738 0.71 PDE4A (0.42) PDE4APDE4CPDE4DCA1CA2
SCHEMBL23825268 0.71 PDE4A (0.38) PDE4APDE4CPDE4DCA1CA2
SCHEMBL29069640 0.68 PDE4A (0.38) PDE4APDE4CPDE4DCA1CA2
SCHEMBL21247743 0.67 CA1 (0.40) PDE4APDE4CPDE4DCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100179143-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-07-15 US disclosed
EP-2154965-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS Glaxosmithkline LLC (US) 2010-02-24 EP disclosed
WO-2008150827-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-12-11 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 (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-20100179143-A1 NAPHTHYRIDINE, DERIVATIVES AS P13 KINASE INHIBITORS INPP5D, PI4KA, PTEN PDE4A 223/4885PDE4C 424/4885PDE4D 224/4885

“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.