SCHEMBL4078368

SCHEMBL4078368

FC(F)(F)Oc1ccc(C(OC2CN(C(c3ccccc3)c3ccccc3)C2)c2ccccc2C(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.52
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39
CCR6 P51684 1/20 0.39
KCNH2 Q12809 1/20 0.39
CACNA2D1 P54289 1/20 0.38
CACNA1B Q00975 1/20 0.38
CACNB1 Q02641 1/20 0.38
CACNA1C Q13936 1/20 0.38
LIPE Q05469 1/20 0.37
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
NAAA Q02083 1/20 0.35
SLC7A5 Q01650 2/20 0.34

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
SCHEMBL4075659 0.91 OPRM1 (0.45) ACHEOPRM1OPRD1OPRK1OPRL1
SCHEMBL4256426 0.89 CACNA2D1 (0.42) ACHEOPRM1OPRD1OPRK1OPRL1
SCHEMBL5781879 0.89 ACHE (0.49) ACHEMEN1KMT2AOPRM1OPRD1
SCHEMBL4079018 0.88 ACHE (0.39) ACHEOPRM1OPRD1OPRK1OPRL1
SCHEMBL4077701 0.88 OPRM1 (0.41) ACHEOPRM1OPRD1OPRK1OPRL1
SCHEMBL4085235 0.87 OPRM1 (0.41) ACHEOPRM1OPRD1OPRK1OPRL1
SCHEMBL4084971 0.87 CNR1 (0.44) MEN1KMT2AOPRM1OPRD1OPRK1
SCHEMBL4075853 0.84 OPRM1 (0.39) ACHEOPRM1OPRD1OPRK1OPRL1
SCHEMBL4075841 0.82 CACNA2D1 (0.38) ACHEMEN1KMT2AOPRM1OPRD1
SCHEMBL4185416 0.80 FAAH (0.38) ACHEOPRM1OPRD1OPRK1OPRL1

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 ACHE 2343/4885MEN1 2044/4885KMT2A 914/4885

“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.