SCHEMBL4083665

SCHEMBL4083665

O=C(NCC1CCCCC1)N1CC(OC(c2ccccc2Cl)c2ccccc2Cl)C1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.57
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
FBP1 P09467 1/20 0.40
FAAH O00519 1/20 0.40
IL1B P01584 2/20 0.40
P2RX7 Q99572 2/20 0.40
EPHX1 P07099 1/20 0.40
CNR2 P34972 1/20 0.39
CXCR4 P61073 1/20 0.39
FDFT1 P37268 1/20 0.39

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
SCHEMBL4078417 0.86 CNR1 (0.57) CNR1FAAHCNR2
SCHEMBL4079548 0.83 CNR1 (0.55) CNR1CNR2
SCHEMBL4079987 0.82 CNR1 (0.57) CNR1FAAHCNR2
SCHEMBL4089449 0.82 CNR1 (0.53) CNR1CNR2
SCHEMBL4087343 0.81 CYP2C19 (0.41) CNR1FAAHCNR2
SCHEMBL4084883 0.80 HPGD (0.43) CNR1NPC1RAB9AFAAH
SCHEMBL4075655 0.79 CNR1 (0.51) CNR1FAAH
SCHEMBL4075813 0.79 CNR1 (0.46) CNR1FAAHCNR2
SCHEMBL4075586 0.79 NPC1 (0.44) CNR1NPC1RAB9AFAAHEPHX1
SCHEMBL4075669 0.78 FABP3 (0.44) CNR1FAAHCNR2

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 6 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 claimed
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 CNR1 1/4885NPC1 205/4885RAB9A 259/4885

“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.