SCHEMBL6326281

SCHEMBL6326281

CC1NCC2CC1CN(Cc1ccccc1)C2

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.43
ACHE P22303 1/20 0.43
KDM1A O60341 1/20 0.42
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
CXCR3 P49682 1/20 0.40
HRH4 Q9H3N8 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
GRIN2B Q13224 2/20 0.39

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
SCHEMBL6311586 0.82 KDM1A (0.47) FUCA1ACHEKDM1ADRD2DRD3
SCHEMBL1711734 0.80 FUCA1 (0.49) FUCA1SIGMAR1
SCHEMBL6325478 0.80 KDM1A (0.50) FUCA1ACHEKDM1ADRD2DRD3
SCHEMBL5811952 0.80 DRD2 (0.42) FUCA1KDM1ADRD2DRD3CXCR3
SCHEMBL25391591 0.79 FUCA1 (0.45) FUCA1ACHEKDM1ADRD2DRD3
SCHEMBL20471517 0.79 FUCA1 (0.45) FUCA1ACHEKDM1ADRD2DRD3
Hydrochloric Acid SCHEMBL22076642 0.78 FUCA1 (0.44) FUCA1ACHEKDM1ADRD2DRD3
SCHEMBL6317794 0.77 FUCA1 (0.51) FUCA1SIGMAR1
SCHEMBL1008411 0.77 FUCA1 (0.51) FUCA1SIGMAR1
SCHEMBL27029864 0.77 FUCA1 (0.45) FUCA1ACHEKDM1ADRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050004113-A1 New bispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2005-01-06 US disclosed
EP-1192156-B1 BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2004-02-18 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-20050004113-A1 New bispidine compounds useful in the treatment of cardiac arrhythmias DRD2, ADRA1D, KCND2 FUCA1 4764/4885ACHE 737/4885KDM1A 3187/4885

“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.