SCHEMBL19336838

SCHEMBL19336838

COc1ccc(Oc2cc(NCCC(F)(F)F)c3ncc(-c4ccc(C5CC5)c(C)c4)n3n2)c(F)c1F

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 20/20 0.75

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
SCHEMBL17445625 0.90 TTK (0.75) TTK
SCHEMBL19336837 0.86 TTK (0.67) TTK
Bay-1217389 SCHEMBL15555839 0.86 TTK (1.00) TTK
Bay-1217389 SCHEMBL30381937 0.86 TTK (1.00) TTK
SCHEMBL17445623 0.81 TTK (0.62) TTK
SCHEMBL17571044 0.81 TTK (0.91) TTK
SCHEMBL17559993 0.80 TTK (0.90) TTK
SCHEMBL16307170 0.79 TTK (0.88) TTK
SCHEMBL19336843 0.79 TTK (0.61) TTK
SCHEMBL19336811 0.79 TTK (0.59) 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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