SCHEMBL3960760

SCHEMBL3960760

O=c1ccc2ncccc2n1CCN1CC[C@H](NCc2ccc(Cl)c(Cl)c2)[C@H](O)C1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 10/20 0.55
CCR3 P51677 3/20 0.38

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
SCHEMBL13767348 0.87 KCNH2 (0.59) KCNH2
SCHEMBL3964438 0.87 KCNH2 (0.59) KCNH2
SCHEMBL3959952 0.86 KCNH2 (0.71) KCNH2
Hydrochloric Acid SCHEMBL3962150 0.85 KCNH2 (0.70) KCNH2
SCHEMBL3962954 0.85 KCNH2 (0.77) KCNH2
SCHEMBL3962206 0.85 KCNH2 (0.77) KCNH2
SCHEMBL3958793 0.83 KCNH2 (0.44) KCNH2
SCHEMBL2686750 0.80 KCNH2 (0.42) KCNH2
SCHEMBL2686753 0.80 KCNH2 (0.42) KCNH2
SCHEMBL3963823 0.79 KCNH2 (0.64) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110319424-A1 NAPHTHYRIDIN-2(1H) -ONE COMPOUNDS USEFUL AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2011-12-29 US claimed
EP-2080761-A1 Compounds GLAXO GROUP LIMITED (GB) 2009-07-22 EP claimed
US-20110319424-A1 NAPHTHYRIDIN-2(1H) -ONE COMPOUNDS USEFUL AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2011-12-29 US disclosed
US-20110319424-A1 NAPHTHYRIDIN-2(1H) -ONE COMPOUNDS USEFUL AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2011-12-29 US disclosed
EP-2080761-A1 Compounds GLAXO GROUP LIMITED (GB) 2009-07-22 EP 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-20110319424-A1 NAPHTHYRIDIN-2(1H) -ONE COMPOUNDS USEFUL AS ANTIBACTERIALS RIF1, MRPL21, NAT1 KCNH2 3252/4885CCR3 4010/4885

“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.