SCHEMBL470054

SCHEMBL470054

Cc1ccc(F)cc1Nc1cc(NCCCC(F)(F)F)c2ncc(-c3ccc(C(N)=O)c(C)c3)n2n1

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
SCHEMBL469969 0.92 TTK (0.46) TTK
SCHEMBL10279106 0.91 TTK (0.54) TTK
SCHEMBL456528 0.89 TTK (0.66) TTK
SCHEMBL469960 0.86 TTK (0.54) TTK
SCHEMBL10279715 0.86 TTK (0.55) TTK
SCHEMBL469970 0.85 TTK (0.50) TTK
SCHEMBL10279268 0.85 TTK (0.59) TTK
SCHEMBL458901 0.84 TTK (0.72) TTK
SCHEMBL470292 0.84 TTK (0.57) TTK
SCHEMBL10279101 0.83 TTK (0.53) 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-2012032031-A1 SUBSTITUTED IMIDAZOPYRIDAZINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-15 WO disclosed