SCHEMBL6581740

SCHEMBL6581740

O=C(NCCCc1ccc(C(F)(F)F)c(F)c1)Nc1cccc2cnccc12

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.66

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
SCHEMBL6584430 0.94 TRPV1 (0.74) TRPV1
SCHEMBL4023447 0.89 TRPV1 (0.77) TRPV1
SCHEMBL5659626 0.86 TRPV1 (0.89) TRPV1
SCHEMBL5658624 0.85 TRPV1 (0.88) TRPV1
SCHEMBL6587146 0.83 ROS1 (0.53) TRPV1
SCHEMBL5659714 0.83 TRPV1 (0.68) TRPV1
SCHEMBL5664749 0.82 TRPV1 (0.66) TRPV1
SCHEMBL4026884 0.81 TRPV1 (0.87) TRPV1
SCHEMBL4030489 0.81 TRPV1 (0.80) TRPV1
SCHEMBL4029208 0.80 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1478363-A1 FUSED AZABICYCLIC COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR Abbott Laboratories (US) 2004-11-24 EP claimed
WO-2003070247-A1 FUSED AZABICYCLIC COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR ABBOTT LABORATORIES (US) 2003-08-28 WO claimed