SCHEMBL4085290

SCHEMBL4085290

Clc1ccccc1C(OC1CN(C(c2ccccc2)c2ccccc2)C1)c1ccccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.47
TDO2 P48775 2/20 0.47
IDO2 Q6ZQW0 2/20 0.47
OPRM1 P35372 3/20 0.43
OPRL1 P41146 2/20 0.43
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
CACNA2D1 P54289 4/20 0.40
CACNA1B Q00975 4/20 0.40
CACNB1 Q02641 4/20 0.40
CACNA1G O43497 1/20 0.40
CACNA1C Q13936 2/20 0.40
FAAH O00519 1/20 0.39
CYP2D6 P10635 2/20 0.38
DRD3 P35462 2/20 0.38
NAAA Q02083 1/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 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
SCHEMBL4075581 0.91 MEN1 (0.48) IDO1TDO2IDO2FAAHCYP2D6
SCHEMBL4186957 0.85 FAAH (0.39) IDO1TDO2IDO2OPRM1OPRL1
SCHEMBL11402799 0.82 DRD3 (0.53) OPRM1OPRD1OPRK1CYP2D6DRD3
SCHEMBL4077695 0.81 MEN1 (0.58) CYP2D6DRD3MEN1TP53CYP1A2
SCHEMBL4079337 0.80 IDO1 (0.51) IDO1TDO2CACNA2D1CACNA1BCACNB1
SCHEMBL4189078 0.78 MEN1 (0.49) FAAHCYP2D6DRD3MEN1TP53
SCHEMBL9450757 0.76 SLC6A4 (0.45) DRD3CHRM2HTR1AADRA2ACHRM1
SCHEMBL4075659 0.75 OPRM1 (0.45) IDO1TDO2OPRM1OPRL1OPRD1
SCHEMBL4182438 0.75 FAAH (0.62) FAAHKCNH2
SCHEMBL4084971 0.75 CNR1 (0.44) OPRM1OPRL1OPRD1OPRK1FAAH

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1620395-B1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS VERNALIS RES LTD (GB) 2009-12-30 EP disclosed
US-7504522-B2 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disorders VERNALIS RESEARCH LIMITED (GB) 2009-03-17 US disclosed
US-20070054891-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disorders VERNALIS RESEARCH LIMAITED (GB) 2007-03-08 US disclosed
EP-1620395-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS VERNALIS RESEARCH LIMITED (GB) 2006-02-01 EP disclosed
WO-2004096763-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS 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 (1 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-20070054891-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disorders CNR1, CNR2, GPR119 IDO1 1142/4885TDO2 1669/4885IDO2 1253/4885

“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.