SCHEMBL4464126

SCHEMBL4464126

O=C(Nc1ccc(C(F)(F)F)cn1)c1ccc(-c2ncccc2C(F)(F)F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 16/20 1.00
▸ PTGS1 P23219 2/20 0.60
▸ PTGES O14684 1/20 0.55
▸ DEGS1 O15121 1/20 0.55

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
SCHEMBL14084066 0.89 TRPV1 (0.80) TRPV1DEGS1
SCHEMBL15779639 0.89 TRPV1 (0.80) TRPV1
SCHEMBL14083442 0.88 TRPV1 (0.79) TRPV1PTGS1DEGS1
SCHEMBL10324365 0.88 TRPV1 (0.78) TRPV1PTGS1DEGS1
SCHEMBL4591053 0.87 TRPV1 (0.78) TRPV1PTGS1DEGS1
SCHEMBL14084119 0.85 TRPV1 (0.74) TRPV1PTGS1PTGESDEGS1
SCHEMBL14083136 0.84 TRPV1 (0.73) TRPV1PTGS1DEGS1
SCHEMBL5934589 0.84 TRPV1 (1.00) TRPV1
SCHEMBL14083271 0.84 TRPV1 (0.72) TRPV1PTGS1PTGESDEGS1
SCHEMBL14083444 0.84 TRPV1 (0.72) TRPV1PTGS1DEGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005073193-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2005-08-11 — — WO claimed
US-20050165015-A1 Vanilloid receptor ligands and their use in treatments AMGEN, INC. 2005-07-28 — — US claimed
US-7553848-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-06-30 — — US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
EP-1725529-A1 BIS BICYCLIC AMIDES AS VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS OF INFLAMMATORY AND NEUROPATIC PAIN Amgen Inc. (US) 2006-11-29 — — EP disclosed
WO-2005070885-A1 BIS BICYCLIC AMIDES AS VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS OF INFLAMMATORY AND NEUROPATIC PAIN AMGEN INC. (US) 2005-08-04 — — WO disclosed
US-20050165046-A1 Vanilloid receptor ligands and their use in treatments AMGEN, INC. 2005-07-28 — — 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 (3 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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 TRPV1 1/4885PTGS1 215/4885PTGES 241/4885
US-20050165015-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 TRPV1 1/4885PTGS1 168/4885PTGES 96/4885
US-20050165046-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 TRPV1 1/4885PTGS1 176/4885PTGES 89/4885

“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.

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