SCHEMBL4182231

SCHEMBL4182231

CC(C)(C)NC(=O)N1CCC(OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2Cl)CC1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 13/20 0.50
CNR2 P34972 9/20 0.50
CYP3A4 P08684 1/20 0.45
CYP3A5 P20815 1/20 0.45
EPHX2 P34913 1/20 0.43
FAAH O00519 1/20 0.42

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
SCHEMBL4079226 0.90 CNR1 (0.47) CNR1CNR2FAAH
SCHEMBL4182341 0.84 FAAH (0.45) CNR1CNR2FAAH
SCHEMBL4184472 0.83 CNR1 (0.67) CNR1CNR2
SCHEMBL4184955 0.83 CNR1 (0.47) CNR1CNR2FAAH
SCHEMBL4184959 0.83 CNR1 (0.47) CNR1CNR2FAAH
SCHEMBL4192823 0.81 FAAH (0.57) CNR1CNR2FAAH
SCHEMBL4075873 0.80 FAAH (0.44) CNR1CNR2FAAH
SCHEMBL4079568 0.79 CNR1 (0.60) CNR1CNR2FAAH
SCHEMBL4080228 0.78 CNR1 (0.48) CNR1CNR2FAAH
SCHEMBL4184482 0.78 CNR1 (0.48) CNR1CNR2CYP3A4FAAH

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 7 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 claimed
US-20070173486-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disordrs VERNALIS RESEARCH LIMITED (GB) 2007-07-26 US claimed
JP-2006525299-A 2006-11-09 JP claimed
EP-1618105-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS VERNALIS RESEARCH LIMITED (GB) 2006-01-25 EP claimed
WO-2004096794-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDRS VERNALIS RESEARCH LIMITED (GB) 2004-11-11 WO claimed
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

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 CNR1 1/4885CNR2 2/4885CYP3A4 947/4885
US-20070173486-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disordrs CNR1, CNR2, GPR119 CNR1 1/4885CNR2 2/4885CYP3A4 1405/4885

“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.