SCHEMBL6409834

SCHEMBL6409834

O=C(O)C1=NOC2(CCN(C(=O)c3ccc(OC(F)(F)F)cc3)CC2)C1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.48
EPHX2 P34913 7/20 0.47
MGLL Q99685 2/20 0.47
HRH3 Q9Y5N1 2/20 0.47
ENPP2 Q13822 2/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
ATXN2 Q99700 1/20 0.42
LSS P48449 1/20 0.42
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
NAMPT P43490 1/20 0.41
MAPK7 Q13164 1/20 0.40
MAPK8 P45983 1/20 0.40
MAPK10 P53779 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
SCHEMBL6410851 0.86 HSD11B1 (0.47) HSD11B1EPHX2MGLLHRH3ENPP2
SCHEMBL15309117 0.85 EPHX2 (0.54) HSD11B1EPHX2MGLL
SCHEMBL2402307 0.85 POLB (0.56)
SCHEMBL2405152 0.84 HSD11B1 (0.46) HSD11B1EPHX2MGLL
SCHEMBL2404620 0.83 NAMPT (0.48) HSD11B1EPHX2MGLLHRH3ENPP2
SCHEMBL6409614 0.83 EPHX2 (0.39) EPHX2
SCHEMBL2402430 0.82 HPGD (0.49) HSD11B1MGLL
SCHEMBL2577819 0.81 NAMPT (0.50) EPHX2HRH3ENPP2NAMPTMAPK8
SCHEMBL2400758 0.81 SLC6A7 (0.44) MGLL
SCHEMBL6410522 0.81 MEN1 (0.53) EPHX2SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401841-B1 SUBSTITUTED 1-OXA-2,8-DIAZA-SPIRO 4,5]DEC-2-ENE DERIVATIVES AS MEDICAMENTS FOR THE TREATMENT OF PAIN GRUENENTHAL GMBH (DE) 2005-08-24 EP claimed
US-8557796-B2 Substituted 1-oxa-2,8-diaza-spiro [4,5] dec-2-ene derivatives and related treatment methods GRUENENTHAL GMBH (DE) 2013-10-15 US disclosed
EP-1401841-B1 SUBSTITUTED 1-OXA-2,8-DIAZA-SPIRO 4,5]DEC-2-ENE DERIVATIVES AS MEDICAMENTS FOR THE TREATMENT OF PAIN GRUENENTHAL GMBH (DE) 2005-08-24 EP disclosed
US-20040192916-A1 Substituted 1-oxa-2,8-diaza-spiro[4,5]dec-2-ene derivatives and related treatment methods GRUENENTHAL GMBH (DE) 2004-09-30 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-20040192916-A1 Substituted 1-oxa-2,8-diaza-spiro[4,5]dec-2-ene derivatives and related treatment methods SULT1E1, CYP4B1, CYP3A4 HSD11B1 615/4885EPHX2 623/4885MGLL 4522/4885

“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.