SCHEMBL19336800

SCHEMBL19336800

COc1ccc(Oc2cc(NCC3COC3)c3ncc(-c4ccc(C(=O)CNC5CC5)c(C)c4)n3n2)cc1F

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 20/20 0.83

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
SCHEMBL15554470 0.91 TTK (1.00) TTK
SCHEMBL17445622 0.86 TTK (0.78) TTK
SCHEMBL17425437 0.85 TTK (0.76) TTK
SCHEMBL456224 0.84 TTK (0.78) TTK
SCHEMBL458692 0.83 TTK (0.76) TTK
SCHEMBL19336826 0.82 TTK (0.70) TTK
SCHEMBL457087 0.80 TTK (0.84) TTK
SCHEMBL10279273 0.80 TTK (0.71) TTK
SCHEMBL15556532 0.80 TTK (0.80) TTK
SCHEMBL458845 0.79 TTK (0.84) 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
EP-2961752-B1 SUBSTITUTED IMIDAZOPYRIDAZINES Bayer Pharma AG (DE) 2017-09-13 — — EP disclosed
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