SCHEMBL4472438

SCHEMBL4472438

CN(C(=O)CCCCC(c1ccc(F)cc1)c1ccc(F)cc1)[C@H]1CCN(C(=O)c2cc(C(C)(C)C)cc(C(C)(C)C)c2)C1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 19/20 0.57

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
SCHEMBL4468854 1.00 KCNH2 (0.57) KCNH2
SCHEMBL4466197 0.92 KCNH2 (0.58) KCNH2
SCHEMBL4474101 0.92 KCNH2 (0.58) KCNH2
SCHEMBL4462692 0.88 KCNH2 (0.69) KCNH2
SCHEMBL4460200 0.88 KCNH2 (0.69) KCNH2
SCHEMBL4458741 0.86 KCNH2 (0.67) KCNH2
SCHEMBL4458743 0.86 KCNH2 (0.67) KCNH2
SCHEMBL4477616 0.86 KCNH2 (0.67) KCNH2
SCHEMBL13934141 0.81 KCNH2 (0.61) KCNH2
SCHEMBL13934142 0.81 CCR5 (0.42) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507760-B2 N-type calcium channel blockers NEUROMED PHARMACEUTICALS LTD. (CA) 2009-03-24 US claimed
US-20050165065-A1 N-type calcium channel blockers ZALICUS PHARMACEUTICALS LTD. (CA) 2005-07-28 US claimed
US-7507760-B2 N-type calcium channel blockers NEUROMED PHARMACEUTICALS LTD. (CA) 2009-03-24 US disclosed
US-20050165065-A1 N-type calcium channel blockers ZALICUS PHARMACEUTICALS LTD. (CA) 2005-07-28 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-20050165065-A1 N-type calcium channel blockers CACNA1B, CACNA1C, CACNA1D KCNH2 46/4885

“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.