SCHEMBL13077293

SCHEMBL13077293

Nc1ccc2c(c1)nc(NCC(F)(F)F)c1ncc(-c3ccc(C(=O)NC4CC4)cc3)n12

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TTK P33981 20/20 0.51

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
SCHEMBL13077294 0.89 TTK (0.53) TTK
SCHEMBL6113320 0.88 TTK (0.52) TTK
SCHEMBL13077033 0.88 TTK (0.59) TTK
SCHEMBL122677 0.88 TTK (0.50) TTK
SCHEMBL13077247 0.88 TTK (0.49) TTK
SCHEMBL13077303 0.88 TTK (0.57) TTK
SCHEMBL13076760 0.87 TTK (0.66) TTK
SCHEMBL13077295 0.87 TTK (0.53) TTK
SCHEMBL13077307 0.85 TTK (0.53) TTK
SCHEMBL13077447 0.84 TTK (0.51) TTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010124826-A1 SUBSTITUTED IMIDAZOQUINOXALINES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-11-04 WO disclosed