SCHEMBL4032211

SCHEMBL4032211

O=C(C(F)=Cc1ccccc1)N1CCN2CCC1CC2

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.51
HTR3A P46098 1/20 0.51
CHRNA3 P32297 1/20 0.43
HPGD P15428 1/20 0.40

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
SCHEMBL13887057 1.00 CHRNA7 (0.51) CHRNA7HTR3ACHRNA3HPGD
SCHEMBL14381382 0.92 CHRNA7 (0.43) CHRNA7HTR3ACHRNA3HPGD
SCHEMBL5634876 0.92 CHRNA7 (0.43) CHRNA7HTR3ACHRNA3HPGD
SCHEMBL372772 0.74 CHRNA7 (0.54) CHRNA7HTR3ACHRNA3HPGD
SCHEMBL4030570 0.71 CHRNA7 (0.60) CHRNA7HTR3ACHRNA3
SCHEMBL6982182 0.68 CHRNA7 (0.56) CHRNA7HTR3ACHRNA3
SCHEMBL7559030 0.68 CHRNA7 (1.00) CHRNA7HTR3ACHRNA3
SCHEMBL4700437 0.67 CHRNA7 (0.55) CHRNA7HTR3AHPGD
Bromide SCHEMBL5674373 0.67 CHRNA7 (0.55) CHRNA7HTR3ACHRNA3
SCHEMBL6153526 0.67 CHRNA7 (0.56) CHRNA7HTR3A

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-1539764-B1 ARYL-SUBSTITUTED DIAZABICYCLOALKANES AS NICOTINIC ACETYLCHOLINE AGONISTS. ASTRAZENECA AB (SE) 2009-04-29 EP claimed
US-20060052368-A1 Aryl-substituted diazabicycloalkanes as nicotinic acetylcholine agonists ASTRAZENECA AB (SE) 2006-03-09 US claimed
EP-1539764-B1 ARYL-SUBSTITUTED DIAZABICYCLOALKANES AS NICOTINIC ACETYLCHOLINE AGONISTS. ASTRAZENECA AB (SE) 2009-04-29 EP disclosed
US-20060052368-A1 Aryl-substituted diazabicycloalkanes as nicotinic acetylcholine agonists ASTRAZENECA AB (SE) 2006-03-09 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-20060052368-A1 Aryl-substituted diazabicycloalkanes as nicotinic acetylcholine agonists CHRNA7, CHRNB1, CHRNA1 CHRNA7 1/4885HTR3A 202/4885CHRNA3 13/4885

“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.