SCHEMBL4080242

SCHEMBL4080242

COc1ccc(C(O)c2ccccc2C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
MAOB P27338 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 3/20 0.44
MAPT P10636 2/20 0.44
GAA P10253 3/20 0.43
SCD O00767 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
GABBR2 O75899 1/20 0.42
GABBR1 Q9UBS5 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ACP3 P15309 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ATM Q13315 1/20 0.40

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
SCHEMBL4075712 0.83 SCD (0.42) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL4075729 0.82 ACP3 (0.44) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL5779727 0.82 EPHX2 (0.45) KMT2AMEN1LMNAMAPTGAA
SCHEMBL30986703 0.81 ACP3 (0.57) KMT2AMEN1MAPTSCDSMN1; SMN2
SCHEMBL3289370 0.81 ACP3 (0.57) KMT2AMEN1MAPTSCDSMN1; SMN2
SCHEMBL3294921 0.81 ACP3 (0.57) KMT2AMEN1MAPTSCDSMN1; SMN2
SCHEMBL4083661 0.80 ACP3 (0.45) KMT2ASCDACP3ATM
SCHEMBL12782173 0.80 MEN1 (0.45) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL4189236 0.79 CNR2 (0.49) ALDH1A1LMNAMAPTSCDTSHR
SCHEMBL1682166 0.78 MEN1 (0.48) KMT2AMEN1ALDH1A1LMNAGAA

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 KMT2A 914/4885MEN1 2044/4885MAOB 836/4885

“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.