SCHEMBL4075712

SCHEMBL4075712

OC(c1ccc(OC(F)F)cc1)c1ccccc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.42
ACP3 P15309 1/20 0.40
PPARG P37231 4/20 0.39
PPARA Q07869 3/20 0.39
CNR2 P34972 1/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TOP2A P11388 1/20 0.36
TOP2B Q02880 1/20 0.36
HSD17B2 P37059 1/20 0.36
EPHX2 P34913 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35

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
SCHEMBL4080242 0.83 KMT2A (0.46) SCDACP3MEN1KMT2AMAPT
SCHEMBL30986703 0.80 ACP3 (0.57) SCDACP3CNR2MEN1KMT2A
SCHEMBL3294921 0.80 ACP3 (0.57) SCDACP3CNR2MEN1KMT2A
SCHEMBL3289370 0.80 ACP3 (0.57) SCDACP3CNR2MEN1KMT2A
SCHEMBL4083661 0.79 ACP3 (0.45) SCDACP3CNR2KMT2ATOP2A
SCHEMBL4189236 0.78 CNR2 (0.49) SCDACP3PPARGPPARACNR2
SCHEMBL4075729 0.78 ACP3 (0.44) SCDACP3CNR2MEN1KMT2A
SCHEMBL7267014 0.77 SRD5A2 (0.47) MEN1KMT2AMAPTLMNAHTT
SCHEMBL9776265 0.76 ACP3 (0.50) ACP3CNR2LMNAIDO1TDO2
SCHEMBL30903830 0.76 ACP3 (0.50) ACP3CNR2LMNAIDO1TDO2

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 SCD 718/4885ACP3 4050/4885PPARG 611/4885

“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.