SCHEMBL6052437

SCHEMBL6052437

CC(C)(C)COc1ccc(NC(=O)c2cnn(-c3ccc(F)cc3)c2)cc1C#N

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.65

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
SCHEMBL13666162 0.86 XDH (0.68) XDH
SCHEMBL6052391 0.84 XDH (0.50) XDH
SCHEMBL6052642 0.83 XDH (0.48) XDH
SCHEMBL6052291 0.83 XDH (0.53) XDH
Water SCHEMBL6052673 0.82 MET (0.51) XDH
SCHEMBL6052355 0.82 MET (0.51) XDH
SCHEMBL6052323 0.81 XDH (0.47) XDH
SCHEMBL6052657 0.80 XDH (0.47) XDH
SCHEMBL7058149 0.79 XDH (0.47) XDH
SCHEMBL440021 0.79 XDH (1.00) XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7015218-B1 Amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-03-21 US disclosed
EP-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 EP disclosed