SCHEMBL4080232

SCHEMBL4080232

O=C(NC1CC2CCC1C2)N1CC(OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 2/20 0.46
RAB9A P51151 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.44
EPHX2 P34913 1/20 0.43
DRD3 P35462 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HSP90AA1 P07900 1/20 0.41
FAAH O00519 6/20 0.41

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
SCHEMBL4080229 1.00 MAPK1 (0.47) MAPK1ALDH1A1RAB9ATDP1LMNA
SCHEMBL29575339 0.90 FAAH (0.44) FAAH
SCHEMBL4079562 0.90 FAAH (0.44) FAAH
SCHEMBL4079560 0.90 FAAH (0.44) FAAH
SCHEMBL4075497 0.83 EPHX2 (0.44) EPHX2DRD3SLC6A3FAAH
SCHEMBL4079984 0.83 EPHX2 (0.40) MAPK1ALDH1A1RAB9ATDP1EPHX2
SCHEMBL4079982 0.83 EPHX2 (0.40) MAPK1ALDH1A1RAB9ATDP1EPHX2
SCHEMBL4084550 0.78 ALDH1A1 (0.52) ALDH1A1LMNAFAAH
SCHEMBL4078364 0.76 CNR1 (0.55) RAB9ADRD3SLC6A3FAAH
SCHEMBL4189458 0.76 DRD3 (0.54) DRD3SLC6A3FAAH

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 3 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

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 MAPK1 846/4885ALDH1A1 1099/4885RAB9A 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.