SCHEMBL16927005

SCHEMBL16927005

O=C1[C@@H]2CCC[C@H]([C@H](CO)CN1Cc1ccccn1)N2S(=O)(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.84

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 16/20 0.80
FKBP5 Q13451 2/20 0.80
FKBP2 P26885 1/20 0.80
FKBP1B P68106 1/20 0.80
FKBP3 Q00688 1/20 0.80
FKBP4 Q02790 1/20 0.80
CNR1 P21554 1/20 0.42

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
SCHEMBL16948808 1.00 FKBP1A (0.80) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL16938952 1.00 FKBP1A (0.80) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL16937330 1.00 FKBP1A (0.80) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL18354147 1.00 FKBP1A (0.80) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL18354017 0.91 FKBP1A (0.83) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL18359763 0.91 FKBP1A (0.83) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL16937341 0.91 FKBP1A (0.80) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL19594696 0.91 FKBP1A (0.83) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL16949299 0.91 FKBP1A (0.80) FKBP1AFKBP5FKBP2FKBP1BFKBP3
SCHEMBL18354620 0.91 FKBP1A (0.80) FKBP1AFKBP5FKBP2FKBP1BFKBP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9914732-B2 Diazabicyclo[4.3.1]decane derivatives for treatment of psychiatric disorders MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSC HAFTEN E.V. (DE) 2018-03-13 US claimed
EP-3097103-B1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS MAX-PLANCK-GESELLSCHAFT ZUR FÖRDERUNG DER WSS (DE) 2017-11-15 EP claimed
US-20170002003-A1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSC HAFTEN E.V. (DE) 2017-01-05 US claimed
EP-3097103-A1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS Max-Planck-Gesellschaft zur Förderung der Wissenschaften (DE) 2016-11-30 EP claimed
WO-2015110271-A1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-07-30 WO claimed
EP-2899192-A1 Diazabicyclo[4.3.1]decane derivatives for treatment of psychiatric disorders Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-07-29 EP claimed
US-9914732-B2 Diazabicyclo[4.3.1]decane derivatives for treatment of psychiatric disorders MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSC HAFTEN E.V. (DE) 2018-03-13 US disclosed
EP-3097103-B1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS MAX-PLANCK-GESELLSCHAFT ZUR FÖRDERUNG DER WSS (DE) 2017-11-15 EP disclosed
US-20170002003-A1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSC HAFTEN E.V. (DE) 2017-01-05 US disclosed
EP-3097103-A1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS Max-Planck-Gesellschaft zur Förderung der Wissenschaften (DE) 2016-11-30 EP disclosed
WO-2015110271-A1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-07-30 WO disclosed
EP-2899192-A1 Diazabicyclo[4.3.1]decane derivatives for treatment of psychiatric disorders Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-07-29 EP 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-20170002003-A1 DIAZABICYCLO[4.3.1]DECANE DERIVATIVES FOR TREATMENT OF PSYCHIATRIC DISORDERS SNCA, DDT, DRD1 FKBP1A 297/4885FKBP5 255/4885FKBP2 352/4885

“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.