SCHEMBL4079982

SCHEMBL4079982

O=C(N[C@H]1C[C@@H]2CC[C@H]1C2)N1CC(OC(c2ccccc2Cl)c2ccccc2Cl)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.40
HPGD P15428 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPT P10636 1/20 0.39
HSD17B10 Q99714 2/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
KCNJ6 P48051 1/20 0.37
KCNJ5 P48544 1/20 0.37
KCNJ3 P48549 1/20 0.37
CNR2 P34972 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL4079984 1.00 EPHX2 (0.40) EPHX2HPGDSMN1; SMN2ALDH1A1MAPT
SCHEMBL4079562 0.92 FAAH (0.44) CNR2
SCHEMBL29575339 0.92 FAAH (0.44) CNR2
SCHEMBL4079560 0.92 FAAH (0.44) CNR2
SCHEMBL4080229 0.83 MAPK1 (0.47) EPHX2ALDH1A1MAPK1RAB9ATDP1
SCHEMBL4080232 0.83 MAPK1 (0.47) EPHX2ALDH1A1MAPK1RAB9ATDP1
SCHEMBL4089449 0.80 CNR1 (0.53) SMN1; SMN2ALDH1A1CNR2
SCHEMBL24433945 0.80 EPHX2 (0.36) EPHX2ALDH1A1CNR2
SCHEMBL4079548 0.79 CNR1 (0.55) SMN1; SMN2ALDH1A1CNR2
SCHEMBL23912852 0.76 OPRM1 (0.37) EPHX2CNR2

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 EPHX2 1008/4885HPGD 1867/4885SMN1; SMN2 2253/4885

“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.