SCHEMBL4031149

SCHEMBL4031149

O=C(c1ccc(F)cc1)N1CCN2CCC1CC2

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.54
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HSD11B1 P28845 2/20 0.50
HTR3A P46098 1/20 0.48
CHRNA3 P32297 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL4031884 0.85 CHRNA7 (0.52) CHRNA7HTR3ACHRNA3
SCHEMBL4028418 0.85 CHRNA7 (0.52) CHRNA7ALDH1A1KMT2AHSD11B1HTR3A
SCHEMBL4028569 0.85 CHRNA7 (0.62) CHRNA7L3MBTL1HSD11B1HTR3ACHRNA3
SCHEMBL4030570 0.85 CHRNA7 (0.60) CHRNA7L3MBTL1HTR3ACHRNA3
SCHEMBL4035487 0.84 MEN1 (0.51) CHRNA7MEN1KMT2AHSD11B1HTR3A
SCHEMBL4027734 0.83 HSD11B1 (0.53) CHRNA7KDM4EALDH1A1HSD11B1
SCHEMBL4700437 0.83 CHRNA7 (0.55) CHRNA7MEN1ALDH1A1KMT2AHSD11B1
SCHEMBL373468 0.81 CHRNA7 (0.55) CHRNA7KDM4EMEN1ALDH1A1KMT2A
SCHEMBL4032137 0.81 HSD11B1 (0.54) CHRNA7HSD11B1HTR3ACHRNA3
SCHEMBL4705060 0.80 CHRNA7 (0.48) CHRNA7KDM4EHTR3APOLB

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 1/4885KDM4E 2622/4885MEN1 2886/4885

“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.