SCHEMBL3327809

SCHEMBL3327809

CC(C)(C)N(C(=O)O)C1CCN(CC2(O)Cn3c(=O)ccc4ncc(F)c2c43)CC1

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 20/20 0.45

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
SCHEMBL3327813 1.00 KCNH2 (0.45) KCNH2
SCHEMBL3326917 0.90 KCNH2 (0.56) KCNH2
SCHEMBL3331892 0.90 KCNH2 (0.37) KCNH2
SCHEMBL3331050 0.88 KCNH2 (0.35) KCNH2
SCHEMBL3220103 0.86 HSD11B1 (0.34) KCNH2
SCHEMBL3325759 0.86 KCNH2 (0.34) KCNH2
SCHEMBL2766739 0.82 KCNH2 (0.49) KCNH2
SCHEMBL2770444 0.82 KCNH2 (0.49) KCNH2
SCHEMBL2768674 0.81 KCNH2 (0.51) KCNH2
SCHEMBL14461107 0.78 KCNH2 (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137353-A1 TRICYCLIC COMPOUNDS AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2010-06-03 US 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-20100137353-A1 TRICYCLIC COMPOUNDS AS ANTIBACTERIALS NRDC, NACA, NOP2 KCNH2 2974/4885

“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.