SCHEMBL3465770

SCHEMBL3465770

CCS(=O)(=O)Nc1ccc(C(C)C(=O)NCc2ccc(C(F)(F)F)cc2N2CCC(C)CC2)cc1F

nearest known ligand 0.87

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.87

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
SCHEMBL3467240 0.94 TRPV1 (0.87) TRPV1
SCHEMBL2523192 0.93 TRPV1 (1.00) TRPV1
SCHEMBL2530165 0.93 TRPV1 (1.00) TRPV1
SCHEMBL2526656 0.93 TRPV1 (1.00) TRPV1
SCHEMBL2525208 0.87 TRPV1 (1.00) TRPV1
SCHEMBL2524969 0.86 TRPV1 (1.00) TRPV1
SCHEMBL14797691 0.86 TRPV1 (0.81) TRPV1
SCHEMBL15834430 0.85 TRPV1 (0.88) TRPV1
SCHEMBL2522985 0.85 TRPV1 (1.00) TRPV1
SCHEMBL2528530 0.85 TRPV1 (1.00) TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252816-B2 [1] N-(2-fluoro-4-(1-oxo-1-((2-(4-(N-phenylpropionamido)piperidin-1-yl)-6-(trifluoro-methyl)pyridin-3-yl)methylamino)propan-2-yl)phenyl)-N-(methylsulfonyl)propionamide; for treating acute pain, chronic pain, neuropathic pain and visceral pain; neurodegenerative disease, airway diseases GRUENENTHAL GMBH (DE) 2012-08-28 US claimed
EP-2146959-A1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS Grünenthal GmbH (DE) 2010-01-27 EP claimed
US-20080269289-A1 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions GRUENENTHAL GMBH (DE) 2008-10-30 US claimed
WO-2008125296-A1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS Grünenthal GmbH (DE) 2008-10-23 WO claimed
US-8642623-B2 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions GRUENENTHAL GMBH (DE) 2014-02-04 US disclosed
EP-2146959-B1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS GRUENENTHAL GMBH (DE) 2013-06-19 EP disclosed
US-20120302602-A1 Vanilloid Receptor Ligand Compounds, Pharmaceutical Compositions Containing Them, a Method of Producing Them and the Use Thereof to Treat Pain and Various Other Conditions GRUENENTHAL GMBH (DE) 2012-11-29 US disclosed
US-8252816-B2 [1] N-(2-fluoro-4-(1-oxo-1-((2-(4-(N-phenylpropionamido)piperidin-1-yl)-6-(trifluoro-methyl)pyridin-3-yl)methylamino)propan-2-yl)phenyl)-N-(methylsulfonyl)propionamide; for treating acute pain, chronic pain, neuropathic pain and visceral pain; neurodegenerative disease, airway diseases GRUENENTHAL GMBH (DE) 2012-08-28 US disclosed
EP-2146959-A1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS Grünenthal GmbH (DE) 2010-01-27 EP disclosed
US-20080269289-A1 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions GRUENENTHAL GMBH (DE) 2008-10-30 US disclosed
WO-2008125296-A1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS Grünenthal GmbH (DE) 2008-10-23 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 (2 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-20080269289-A1 Vanilloid receptor ligand compounds, pharmaceutical compositions containing them, a method of producing them and the use thereof to treat pain and various other conditions TRPV1, TRPV2, TRPV3 TRPV1 1/4885
US-20120302602-A1 Vanilloid Receptor Ligand Compounds, Pharmaceutical Compositions Containing Them, a Method of Producing Them and the Use Thereof to Treat Pain and Various Other Conditions TRPV1, TRPV2, TRPV3 TRPV1 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.