SCHEMBL4880272

SCHEMBL4880272

c1cc[n+](CCCCCCCCCCC[n+]2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 1.00
ACHE P22303 7/20 1.00

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
SCHEMBL3605494 1.00 BCHE (1.00) BCHEACHE
SCHEMBL3609657 1.00 BCHE (1.00) BCHEACHE
SCHEMBL3589030 1.00 BCHE (1.00) BCHEACHE
SCHEMBL3589499 1.00 BCHE (1.00) BCHEACHE
SCHEMBL3598000 1.00 BCHE (1.00) BCHEACHE
SCHEMBL3599570 1.00 BCHE (1.00) BCHEACHE
Bromide SCHEMBL3591238 0.97 BCHE (1.00) BCHEACHE
Iodide SCHEMBL5321839 0.97 BCHE (0.94) BCHEACHE
Bromide SCHEMBL6354341 0.97 BCHE (1.00) BCHEACHE
Bromide SCHEMBL9764843 0.97 BCHE (1.00) BCHEACHE

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-20080287490-A1 Bis-pyridino containing compounds for the use in the treatment of CNS pathologies UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2008-11-20 US claimed
US-20050261334-A1 Bis-pyridino containing compounds for the use in the treatment of CNS pathologies UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2005-11-24 US claimed
US-20080287490-A1 Bis-pyridino containing compounds for the use in the treatment of CNS pathologies UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2008-11-20 US disclosed
US-20050261334-A1 Bis-pyridino containing compounds for the use in the treatment of CNS pathologies UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2005-11-24 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 (2 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-20050261334-A1 Bis-pyridino containing compounds for the use in the treatment of CNS pathologies SLC18A3, SLC18A2, CHRNB2 BCHE 58/4885ACHE 43/4885
US-20080287490-A1 Bis-pyridino containing compounds for the use in the treatment of CNS pathologies SLC18A3, SLC18A2, CHRNB2 BCHE 58/4885ACHE 43/4885

“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.