SCHEMBL13698245

SCHEMBL13698245

CN1CCC(c2cccc3ccccc23)C1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.61
SLC6A4 P31645 1/20 0.61
KDM4E B2RXH2 1/20 0.57
ATM Q13315 1/20 0.57
HRH3 Q9Y5N1 1/20 0.46
HTR6 P50406 5/20 0.44
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43

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
SCHEMBL21369339 0.90 DRD2 (0.55) DRD2SLC6A4KDM4EATMHRH3
SCHEMBL7256238 0.90 DRD2 (0.69) DRD2SLC6A4KDM4EATMHRH3
Bromide SCHEMBL9325759 0.88 DRD2 (0.68) DRD2SLC6A4KDM4EATMHRH3
Hydrochloric Acid SCHEMBL7260916 0.88 DRD2 (0.68) DRD2SLC6A4KDM4EATMHRH3
SCHEMBL6307413 0.82 HTR1D (0.48) DRD2SLC6A4KDM4EATMHRH3
SCHEMBL13698235 0.82 KDM4E (0.56) DRD2SLC6A4KDM4EATMHTR6
SCHEMBL13698257 0.81 KDM4E (0.55) DRD2SLC6A4KDM4EATMHTR6
SCHEMBL24519848 0.77 KDM4E (0.54) SLC6A4KDM4EATM
SCHEMBL15830146 0.77 KDM4E (0.54) KDM4EATMHTR2C
SCHEMBL10212349 0.77 KDM4E (0.54) KDM4EATMHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120302619-A1 Novel 1-aryl-3-Azabicyclo[3.1.0]Hexanes: Preparation And Use To Treat Neuropsychiatric Disorders OTSUKA AMERICA PHARMACEUTICAL, INC. 2012-11-29 US disclosed
US-20090233978-A1 Novel 1-Aryl-3-Azabicyclo[3.1.0]Hexanes: Preparation And Use To Treat Neuropsychiatric Disorders OTSUKA AMERICA PHARMACEUTICAL, INC. 2009-09-17 US disclosed
US-20070082940-A1 Novel 1-aryl-3-azabicyclo[3.1.0]hexanes: preparation and use to treat neuropsychiatric disorders OTSUKA AMERICA PHARMACEUTICAL, INC. 2007-04-12 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 (3 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-20120302619-A1 Novel 1-aryl-3-Azabicyclo[3.1.0]Hexanes: Preparation And Use To Treat Neuropsychiatric Disorders HTR3C, HTR1B, HTR2C DRD2 35/4885SLC6A4 221/4885KDM4E 778/4885
US-20070082940-A1 Novel 1-aryl-3-azabicyclo[3.1.0]hexanes: preparation and use to treat neuropsychiatric disorders HTR3C, HTR1B, HTR2C DRD2 35/4885SLC6A4 221/4885KDM4E 778/4885
US-20090233978-A1 Novel 1-Aryl-3-Azabicyclo[3.1.0]Hexanes: Preparation And Use To Treat Neuropsychiatric Disorders HTR3C, HTR1B, HTR2C DRD2 35/4885SLC6A4 221/4885KDM4E 778/4885

“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.