SCHEMBL4636071

SCHEMBL4636071

C=CCNC(=O)N1CC(OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.43
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
CYP2C19 P33261 1/20 0.42
KCNH2 Q12809 1/20 0.42
MGLL Q99685 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
SCHEMBL4193428 0.91 FAAH (0.43) FAAHCNR1
SCHEMBL4193435 0.91 FAAH (0.43) FAAHCNR1
SCHEMBL4088458 0.85 CNR1 (0.47) FAAHCNR1CNR2CYP2C19KCNH2
SCHEMBL4078364 0.82 CNR1 (0.55) FAAHCNR1
SCHEMBL9596858 0.81 EPHX2 (0.48)
SCHEMBL4084883 0.81 HPGD (0.43) FAAHCNR1MGLL
SCHEMBL4635589 0.81 FAAH (0.48) FAAHCNR1CNR2
SCHEMBL4635584 0.81 FAAH (0.48) FAAHCNR1CNR2
SCHEMBL4635988 0.80 ALDH1A1 (0.41) FAAHCYP2C19MGLL
SCHEMBL4079987 0.79 CNR1 (0.57) FAAHCNR1CNR2CYP2C19KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1617839-B1 THE USE OF AZETIDINECARBOXAMIDE DERIVATIVES IN THERAPY VERNALIS RES LTD (GB) 2008-06-18 EP claimed
US-20060276452-A1 Use of azetidinecarboxamide derivatives in therapy VERNALIS RESEARCH LIMITED (GB) 2006-12-07 US claimed
EP-1617839-A1 THE USE OF AZETIDINECARBOXAMIDE DERIVATIVES IN THERAPY VERNALIS RESEARCH LIMITED (GB) 2006-01-25 EP claimed
WO-2004096209-A1 THE USE OF AZETIDINECARBOXAMIDE DERIVATIVES IN THERAPY VERNALIS RESEARCH LIMITED (GB) 2004-11-11 WO claimed
EP-1049672-B1 AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS VERNALIS RES LTD (GB) 2003-09-17 EP claimed
EP-1212054-A2 AZETIDINE COMPOUNDS IN CNS AND EYE DISEASES VERNALIS RESEARCH LIMITED (GB) 2002-06-12 EP claimed
US-6403574-B1 TRANQUILIZERS, ANTIEPILEPTIC, MUSCLE RELAXATION PRIOR TO SURGERY VERNALIS RESEARCH LIMITED (GB) 2002-06-11 US claimed
WO-2001007023-A2 AZETIDINE COMPOUNDS IN CNS AND EYE DISEASES VERNALIS RESEARCH LIMITED (GB) 2001-02-01 WO claimed
EP-1049672-A1 AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS VERNALIS RESEARCH LIMITED (GB) 2000-11-08 EP claimed
WO-1999037612-A1 AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS VERNALIS RESEARCH LIMITED (GB) 1999-07-29 WO claimed
EP-1617839-B1 THE USE OF AZETIDINECARBOXAMIDE DERIVATIVES IN THERAPY VERNALIS RES LTD (GB) 2008-06-18 EP disclosed
US-20060276452-A1 Use of azetidinecarboxamide derivatives in therapy VERNALIS RESEARCH LIMITED (GB) 2006-12-07 US disclosed
EP-1617839-A1 THE USE OF AZETIDINECARBOXAMIDE DERIVATIVES IN THERAPY VERNALIS RESEARCH LIMITED (GB) 2006-01-25 EP disclosed
WO-2004096209-A1 THE USE OF AZETIDINECARBOXAMIDE DERIVATIVES IN THERAPY VERNALIS RESEARCH LIMITED (GB) 2004-11-11 WO disclosed
EP-1049672-B1 AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS VERNALIS RES LTD (GB) 2003-09-17 EP disclosed
EP-1212054-A2 AZETIDINE COMPOUNDS IN CNS AND EYE DISEASES VERNALIS RESEARCH LIMITED (GB) 2002-06-12 EP disclosed
US-6403574-B1 TRANQUILIZERS, ANTIEPILEPTIC, MUSCLE RELAXATION PRIOR TO SURGERY VERNALIS RESEARCH LIMITED (GB) 2002-06-11 US disclosed
WO-2001007023-A2 AZETIDINE COMPOUNDS IN CNS AND EYE DISEASES VERNALIS RESEARCH LIMITED (GB) 2001-02-01 WO disclosed
EP-1049672-A1 AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS VERNALIS RESEARCH LIMITED (GB) 2000-11-08 EP disclosed
WO-1999037612-A1 AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS VERNALIS RESEARCH LIMITED (GB) 1999-07-29 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-20060276452-A1 Use of azetidinecarboxamide derivatives in therapy CNR1, CNR2, GPR18 FAAH 5/4885CNR1 1/4885CNR2 2/4885

“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.