SCHEMBL2762809

SCHEMBL2762809

O=C(Oc1ccc2c(c1)Cc1ccccc1-2)N1CCN2CCC1CC2

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRNA3 P32297 3/20 0.67
CHRNA7 P36544 2/20 0.63
HTR3A P46098 1/20 0.63

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
SCHEMBL4429334 0.94 CHRNA3 (0.59) CHRNA3CHRNA7HTR3A
SCHEMBL2763026 0.85 CHRNA3 (0.68) CHRNA3CHRNA7HTR3A
SCHEMBL2763192 0.83 CHRNA3 (0.65) CHRNA3CHRNA7HTR3A
SCHEMBL2762690 0.83 CHRNA3 (0.45) CHRNA3CHRNA7HTR3A
SCHEMBL5914764 0.80 CHRNA3 (1.00) CHRNA3CHRNA7HTR3A
SCHEMBL7559030 0.78 CHRNA7 (1.00) CHRNA3CHRNA7HTR3A
SCHEMBL2908050 0.76 CHRNA7 (0.89) CHRNA3CHRNA7HTR3A
SCHEMBL7556223 0.76 CHRNA7 (0.84) CHRNA3CHRNA7HTR3A
SCHEMBL4190184 0.76 CHRNA7 (0.78) CHRNA3CHRNA7HTR3A
SCHEMBL5914683 0.76 CHRNA7 (0.78) CHRNA3CHRNA7HTR3A

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
EP-2029594-B1 NOVEL 1,4-DIAZA-BICYCLO[3.2.2]NONANE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH AS (DK) 2010-10-20 EP claimed
US-20090118265-A1 NOVEL 1,4-DIAZA-BICYCLO[3.2.2]NONANE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2009-05-07 US claimed
EP-2029594-B1 NOVEL 1,4-DIAZA-BICYCLO[3.2.2]NONANE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH AS (DK) 2010-10-20 EP disclosed
US-20090118265-A1 NOVEL 1,4-DIAZA-BICYCLO[3.2.2]NONANE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2009-05-07 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-20090118265-A1 NOVEL 1,4-DIAZA-BICYCLO[3.2.2]NONANE DERIVATIVES AND THEIR MEDICAL USE CHRNA2, CHRNA3, CHRNA10 CHRNA3 2/4885CHRNA7 6/4885HTR3A 71/4885

“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.