SCHEMBL19336855

SCHEMBL19336855

COc1ccc(Oc2cc(NCC3CCOCC3)c3ncc(-c4cccc(C)c4)n3n2)c(F)c1F

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 15/20 0.71
▸ FYN P06241 4/20 0.51
▸ PIM1 P11309 1/20 0.42

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
SCHEMBL17445626 0.90 TTK (0.78) TTKFYN
SCHEMBL17445627 0.86 TTK (0.66) TTKFYN
SCHEMBL19336831 0.84 TTK (0.65) TTKFYN
SCHEMBL16001600 0.83 TTK (1.00) TTK
SCHEMBL19336826 0.82 TTK (0.70) TTKFYN
SCHEMBL19336837 0.82 TTK (0.67) TTKFYNPIM1
SCHEMBL17425437 0.76 TTK (0.76) TTKFYN
SCHEMBL10279273 0.76 TTK (0.71) TTKFYN
SCHEMBL456224 0.75 TTK (0.78) TTKFYN
SCHEMBL458770 0.75 TTK (0.74) 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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