SCHEMBL4287549

SCHEMBL4287549

Cn1ccc2ncnc(O)c21

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 18/20 0.43
IRAK4 Q9NWZ3 1/20 0.42
EIF4E P06730 1/20 0.36
MKNK1 Q9BUB5 1/20 0.36
MKNK2 Q9HBH9 1/20 0.36

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
SCHEMBL22547844 0.79 IRAK4 (0.46) KDRIRAK4
SCHEMBL13856330 0.78 IRAK4 (0.43) KDRIRAK4EIF4EMKNK1MKNK2
SCHEMBL24197723 0.77 IRAK4 (0.40) KDRIRAK4EIF4EMKNK1MKNK2
SCHEMBL23135905 0.76 IRAK4 (0.42) KDRIRAK4EIF4EMKNK1MKNK2
SCHEMBL130754 0.76 KDR (0.44) KDRIRAK4MKNK1MKNK2
SCHEMBL30051491 0.76 KDR (0.44) KDRIRAK4MKNK1MKNK2
SCHEMBL25473176 0.73 IRAK4 (0.40) KDRIRAK4EIF4EMKNK1MKNK2
SCHEMBL21362965 0.73 IRAK4 (0.40) KDRIRAK4EIF4EMKNK1MKNK2
SCHEMBL22863238 0.68 PIK3CB (0.34)
SCHEMBL17873890 0.68 DPP4 (0.44)

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-20090137580-A1 Fused Heterocyclic Derivatives and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 US disclosed
EP-1904498-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2008-04-02 EP disclosed
WO-2007004749-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 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-20090137580-A1 Fused Heterocyclic Derivatives and Use Thereof TIE1, KDR, FLT1 KDR 2/4885IRAK4 2370/4885EIF4E 2624/4885

“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.