SCHEMBL4296835

SCHEMBL4296835

COc1cc(F)c2ccc(=O)n(CCN3CCC(N(Cc4cc5c(cn4)OCCO5)C(=O)O)CC3)c2c1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 17/20 0.56
SLC2A1 P11166 1/20 0.43

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
SCHEMBL4297655 0.91 KCNH2 (0.51) KCNH2SLC2A1
SCHEMBL4303026 0.89 KCNH2 (0.51) KCNH2
SCHEMBL4306134 0.88 KCNH2 (0.72) KCNH2
SCHEMBL4297660 0.88 KCNH2 (0.45) KCNH2SLC2A1
SCHEMBL3864975 0.88 KCNH2 (0.64) KCNH2
SCHEMBL4136801 0.85 KCNH2 (0.56) KCNH2
SCHEMBL5036787 0.85 KCNH2 (0.60) KCNH2
SCHEMBL3869402 0.84 KCNH2 (0.78) KCNH2SLC2A1
Benzoic Acid SCHEMBL4302605 0.83 KCNH2 (0.68) KCNH2SLC2A1
SCHEMBL4149494 0.83 KCNH2 (0.57) KCNH2SLC2A1

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-8071592-B2 Derivatives and analogs of N-ethylquinolones and N-ethylazaquinolones GLAXO GROUP LIMITED (GB) 2011-12-06 US disclosed
US-20090270374-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES GLAXO GROUP LIMITED (GB) 2009-10-29 US disclosed
EP-1992628-A1 Derivatives and analogs of N-ethylquinolones and N-ethylazaquinolones GLAXO GROUP LIMITED (GB) 2008-11-19 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-20090270374-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES ETFA, NQO2, GNAQ KCNH2 2142/4885SLC2A1 4500/4885

“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.