SCHEMBL13698223

SCHEMBL13698223

CCN1CCC(c2ccc(F)c(C)c2)C1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.43
DRD3 P35462 5/20 0.43
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
TLR7 Q9NYK1 1/20 0.41
HTR1A P08908 3/20 0.41
DRD1 P21728 3/20 0.41
DRD4 P21917 3/20 0.41
DRD5 P21918 3/20 0.41
SLC6A4 P31645 2/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 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
SCHEMBL13698251 0.88 TLR7 (0.46) DRD2DRD3TLR7HTR1ADRD1
SCHEMBL13698209 0.88 DRD2 (0.45) DRD2DRD3TLR7HTR1ADRD1
SCHEMBL13698237 0.84 DRD2 (0.48) DRD2DRD3HTR1ADRD1DRD4
SCHEMBL13698242 0.81 SLC6A2 (0.48) DRD2DRD3HTR2AHTR2CHTR2B
SCHEMBL25004991 0.79 DRD2 (0.47) DRD2DRD3HTR2AHTR1ADRD1
SCHEMBL13698248 0.78 DRD2 (0.44) DRD2DRD3HTR2AHTR2CHTR2B
SCHEMBL14046655 0.78 QDPR (0.56) DRD3HTR2AHTR2CHTR2BTLR7
SCHEMBL14544199 0.77 DRD2 (0.49) DRD2DRD3DRD4
SCHEMBL21148630 0.77 DRD3 (0.54) DRD2DRD3HTR1ADRD1DRD4
SCHEMBL12188754 0.76 HTR2C (0.50) HTR2AHTR2CHTR2BSLC6A4SLC6A2

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 35/4885DRD3 32/4885HTR2A 20/4885
US-20070082940-A1 Novel 1-aryl-3-azabicyclo[3.1.0]hexanes: preparation and use to treat neuropsychiatric disorders HTR3C, HTR1B, HTR2C DRD2 35/4885DRD3 32/4885HTR2A 20/4885
US-20090233978-A1 Novel 1-Aryl-3-Azabicyclo[3.1.0]Hexanes: Preparation And Use To Treat Neuropsychiatric Disorders HTR3C, HTR1B, HTR2C DRD2 35/4885DRD3 32/4885HTR2A 20/4885

“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.