SCHEMBL13698227

SCHEMBL13698227

CC(C)N1CCC(c2ccc(Cl)cc2Cl)C1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 2/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
AGTR1 P30556 1/20 0.41
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
DPP4 P27487 1/20 0.38
GRM5 P41594 1/20 0.38
USP2 O75604 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL12000674 0.81 PDE9A (0.46)
SCHEMBL1824248 0.80 MEN1 (0.46) PROKR1GAATSHRAGTR1
SCHEMBL26869113 0.78 DRD2 (0.50) PROKR1DRD2DRD3
SCHEMBL13698239 0.77 DRD2 (0.46) PROKR1GAATSHRAGTR1DRD2
SCHEMBL1821499 0.76 GAA (0.51) PROKR1GAATSHRAGTR1DPP4
SCHEMBL4969638 0.76 OPRL1 (0.47) GAATSHRAGTR1DRD2GRM5
SCHEMBL13698254 0.74 SLC6A4 (0.56) DRD2DRD3MAPT
SCHEMBL13698216 0.74 DRD2 (0.43) DRD2DRD3
SCHEMBL13698215 0.73 GRM2 (0.45) DRD2DRD3
SCHEMBL433540 0.72 GAA (0.52) GAATSHRAGTR1USP2MAPT

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 PROKR1 4183/4885GAA 2684/4885TSHR 1995/4885
US-20070082940-A1 Novel 1-aryl-3-azabicyclo[3.1.0]hexanes: preparation and use to treat neuropsychiatric disorders HTR3C, HTR1B, HTR2C PROKR1 4183/4885GAA 2684/4885TSHR 1995/4885
US-20090233978-A1 Novel 1-Aryl-3-Azabicyclo[3.1.0]Hexanes: Preparation And Use To Treat Neuropsychiatric Disorders HTR3C, HTR1B, HTR2C PROKR1 4183/4885GAA 2684/4885TSHR 1995/4885

“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.