SCHEMBL336298

SCHEMBL336298

O=C1CC2(CCN(c3ccc(OC(F)(F)F)cc3)C2=O)CCN1S(=O)(=O)c1ccccc1Cl

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 20/20 0.79

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
SCHEMBL745848 0.88 LIPE (1.00) LIPE
SCHEMBL336543 0.85 LIPE (0.61) LIPE
SCHEMBL3749714 0.78 LIPE (0.81) LIPE
SCHEMBL348217 0.78 LIPE (1.00) LIPE
SCHEMBL743640 0.77 LIPE (0.79) LIPE
SCHEMBL3745588 0.77 LIPE (0.79) LIPE
SCHEMBL336482 0.77 LIPE (0.59) LIPE
SCHEMBL609375 0.77 LIPE (0.72) LIPE
SCHEMBL745795 0.76 LIPE (0.77) LIPE
SCHEMBL349602 0.76 LIPE (1.00) LIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2558464-B1 AZACYCLIC SPIRODERIVATIVES AS HSL INHIBITORS HOFFMANN LA ROCHE (CH) 2014-06-18 EP claimed
EP-2558464-A1 AZACYCLIC SPIRODERIVATIVES AS HSL INHIBITORS F. Hoffmann-La Roche AG (CH) 2013-02-20 EP claimed
US-8097634-B2 Azacyclic derivatives HOFFMANN-LA ROCHE INC. (US) 2012-01-17 US claimed
WO-2011128316-A1 AZACYCLIC SPIRODERIVATIVES AS HSL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-10-20 WO claimed
US-20110257212-A1 NEW AZACYCLIC DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-10-20 US claimed
EP-2558464-B1 AZACYCLIC SPIRODERIVATIVES AS HSL INHIBITORS HOFFMANN LA ROCHE (CH) 2014-06-18 EP disclosed
EP-2558464-A1 AZACYCLIC SPIRODERIVATIVES AS HSL INHIBITORS F. Hoffmann-La Roche AG (CH) 2013-02-20 EP disclosed
US-8097634-B2 Azacyclic derivatives HOFFMANN-LA ROCHE INC. (US) 2012-01-17 US disclosed
US-8097634-B2 Azacyclic derivatives HOFFMANN-LA ROCHE INC. (US) 2012-01-17 US disclosed
US-8097634-B2 Azacyclic derivatives HOFFMANN-LA ROCHE INC. (US) 2012-01-17 US disclosed
WO-2011128316-A1 AZACYCLIC SPIRODERIVATIVES AS HSL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-10-20 WO disclosed
US-20110257212-A1 NEW AZACYCLIC DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-10-20 US disclosed
US-20110257212-A1 NEW AZACYCLIC DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-10-20 US disclosed
US-20110257212-A1 NEW AZACYCLIC DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-10-20 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-20110257212-A1 NEW AZACYCLIC DERIVATIVES LIPE, GPR119, LPL LIPE 1/4885

“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.