SCHEMBL4182222

SCHEMBL4182222

Clc1ccccc1C(OC1CCN(Cc2ccccc2)CC1)c1ccccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.49
SIGMAR1 Q99720 2/20 0.48
CCR3 P51677 1/20 0.48
ALDH1A1 P00352 2/20 0.47
ATM Q13315 1/20 0.47
HRH3 Q9Y5N1 2/20 0.46
BCHE P06276 1/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL4193409 0.90 FAAH (0.53) SIGMAR1ALDH1A1BCHE
SCHEMBL4184963 0.81 ALDH1A1 (0.56) SIGMAR1ALDH1A1BCHEDRD2DRD4
SCHEMBL4182220 0.80 FAAH (0.49) ACHESIGMAR1ALDH1A1BCHE
SCHEMBL4195949 0.79 SLC6A2 (0.51) ACHEHRH3DRD3
SCHEMBL1475303 0.77 CCR3 (0.54) CCR3ALDH1A1ATMGAA
SCHEMBL4119205 0.75 SMN1; SMN2 (0.65) ACHESIGMAR1CCR3ALDH1A1ATM
Hydrochloric Acid SCHEMBL9353055 0.74 BCHE (0.52) ACHEALDH1A1HRH3BCHEDRD2
SCHEMBL11689917 0.73 ACHE (0.54) ACHESIGMAR1CCR3HRH3BCHE
SCHEMBL9252381 0.73 IDO1 (0.41) HRH3DRD2DRD4DRD3
SCHEMBL4192982 0.73 HRH1 (0.43)

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-20090181939-A1 Azetidinecarboxamide Derivatives And Their Use In The Treatment Of CB1 Receptor Mediated Disorders VERNALIS RESEARCH LIMITED. (GB) 2009-07-16 US disclosed
US-20070173486-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disordrs VERNALIS RESEARCH LIMITED (GB) 2007-07-26 US disclosed
EP-1618105-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS VERNALIS RESEARCH LIMITED (GB) 2006-01-25 EP disclosed
WO-2004096794-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDRS VERNALIS RESEARCH LIMITED (GB) 2004-11-11 WO 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 (2 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-20090181939-A1 Azetidinecarboxamide Derivatives And Their Use In The Treatment Of CB1 Receptor Mediated Disorders CNR1, CNR2, GPR119 ACHE 3380/4885SIGMAR1 201/4885CCR3 621/4885
US-20070173486-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disordrs CNR1, CNR2, GPR119 ACHE 3086/4885SIGMAR1 85/4885CCR3 613/4885

“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.