SCHEMBL13698257

SCHEMBL13698257

CN1CCC(c2ccc(F)c3ccccc23)C1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
ATM Q13315 1/20 0.55
HTR6 P50406 6/20 0.48
DRD2 P14416 1/20 0.41
SLC6A4 P31645 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
SCHEMBL13698235 0.83 KDM4E (0.56) KDM4EATMHTR6DRD2SLC6A4
SCHEMBL13698245 0.81 DRD2 (0.61) KDM4EATMHTR6DRD2SLC6A4
SCHEMBL13416055 0.80 KDM4E (0.53) KDM4EATMHTR6DRD2
SCHEMBL1824890 0.78 KDM4E (0.47) KDM4EATMHTR6
SCHEMBL30877236 0.77 KDM4E (0.64) KDM4EATMHTR6SLC6A4
SCHEMBL1826496 0.75 KDM4E (0.44) KDM4EATMHTR6
SCHEMBL1824551 0.75 OPRL1 (0.58) KDM4EATMHTR6
SCHEMBL1824241 0.74 GRM2 (0.45) KDM4EATMHTR6DRD2SLC6A4
SCHEMBL13993871 0.73 KDM4E (0.42) KDM4EATMHTR6SLC6A4
SCHEMBL21369339 0.72 DRD2 (0.55) KDM4EATMHTR6DRD2SLC6A4

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 KDM4E 778/4885ATM 3351/4885HTR6 11/4885
US-20070082940-A1 Novel 1-aryl-3-azabicyclo[3.1.0]hexanes: preparation and use to treat neuropsychiatric disorders HTR3C, HTR1B, HTR2C KDM4E 778/4885ATM 3351/4885HTR6 11/4885
US-20090233978-A1 Novel 1-Aryl-3-Azabicyclo[3.1.0]Hexanes: Preparation And Use To Treat Neuropsychiatric Disorders HTR3C, HTR1B, HTR2C KDM4E 778/4885ATM 3351/4885HTR6 11/4885

“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.