SCHEMBL6033698

SCHEMBL6033698

FC(F)(F)c1ccc(Nc2ccnc(-c3ccc4cccnc4c3)c2)cc1.FC(F)(F)c1ccc(Nc2ncnc(-c3ccc4cccnc4c3)c2Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.56

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
SCHEMBL6249602 0.92 TRPV1 (0.58) TRPV1
SCHEMBL6253017 0.87 TRPV1 (0.65) TRPV1
SCHEMBL6033658 0.82 TRPV1 (0.60) TRPV1
SCHEMBL5813868 0.81 TRPV1 (0.59) TRPV1
SCHEMBL5802054 0.80 TRPV1 (0.58) TRPV1
SCHEMBL5800155 0.80 TRPV1 (0.58) TRPV1
SCHEMBL6033679 0.80 TRPV1 (0.58) TRPV1
SCHEMBL5798974 0.79 TRPV1 (0.60) TRPV1
SCHEMBL5815210 0.78 TRPV1 (0.56) TRPV1
SCHEMBL6033606 0.78 TRPV1 (0.55) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685124-A1 SUBSTITUTED NITROGEN-CONTAINING SIX-MEMBERED AMINO-HETEROCYCLES AS VANILLOID-1 RECEPTOR ANTAGONISTS FOR TREATING PAIN MERCK SHARP & DOHME LTD. (GB) 2006-08-02 EP disclosed
WO-2005047279-A1 SUBSTITUTED NITROGEN-CONTAINING SIX-MEMBERED AMINO-HETEROCYCLES AS VANILLOID-1 RECEPTOR ANTAGONISTS FOR TREATING PAIN MERCK SHARP & DOHME LIMITED (GB) 2005-05-26 WO disclosed