SCHEMBL13698262

SCHEMBL13698262

CC(C)CN1CCC(c2ccc(Cl)c(Cl)c2)C1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 10/20 0.57
SLC6A4 P31645 10/20 0.57
SLC6A3 Q01959 10/20 0.57
KCNH2 Q12809 6/20 0.57
CYP2D6 P10635 5/20 0.43
DRD2 P14416 1/20 0.41

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
SCHEMBL13698240 0.83 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL13698247 0.81 DRD2 (0.60) SLC6A2SLC6A4SLC6A3KCNH2DRD2
SCHEMBL13698254 0.79 SLC6A4 (0.56) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL14544188 0.78 SLC18A3 (0.45) DRD2
SCHEMBL27015512 0.78 DRD2 (0.53) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL13698261 0.78 DRD3 (0.61) SLC6A2SLC6A4SLC6A3KCNH2DRD2
SCHEMBL24685377 0.77 DRD3 (0.62) SLC6A2SLC6A4SLC6A3KCNH2DRD2
SCHEMBL12768109 0.76 SLC18A3 (0.56) DRD2
SCHEMBL1824340 0.76 SLC6A2 (0.79) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL23374659 0.76 SLC18A3 (0.56) DRD2

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
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
US-20070082939-A1 Methods and compositions for the treatment of neuropathies and related disorders LIPPA ARNOLD S 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 (4 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 SLC6A2 276/4885SLC6A4 221/4885SLC6A3 92/4885
US-20070082940-A1 Novel 1-aryl-3-azabicyclo[3.1.0]hexanes: preparation and use to treat neuropsychiatric disorders HTR3C, HTR1B, HTR2C SLC6A2 276/4885SLC6A4 221/4885SLC6A3 92/4885
US-20090233978-A1 Novel 1-Aryl-3-Azabicyclo[3.1.0]Hexanes: Preparation And Use To Treat Neuropsychiatric Disorders HTR3C, HTR1B, HTR2C SLC6A2 276/4885SLC6A4 221/4885SLC6A3 92/4885
US-20070082939-A1 Methods and compositions for the treatment of neuropathies and related disorders ACHE, LTC4S, CCR5 SLC6A2 1776/4885SLC6A4 1519/4885SLC6A3 955/4885

“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.