SCHEMBL469939

SCHEMBL469939

Cc1cc(-c2cnc3c(NCCC(F)(F)F)cc(Oc4cccc(Cl)c4)nn23)ccc1C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TTK P33981 19/20 0.57
MAPK10 P53779 1/20 0.45

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
SCHEMBL456407 0.92 TTK (0.60) TTK
SCHEMBL10279499 0.92 TTK (0.61) TTK
SCHEMBL469954 0.91 TTK (0.57) TTK
SCHEMBL10279537 0.90 TTK (0.60) TTK
SCHEMBL458195 0.89 TTK (0.73) TTK
SCHEMBL13193172 0.86 TTK (0.53) TTK
SCHEMBL470082 0.85 TTK (0.67) TTK
SCHEMBL470014 0.85 TTK (0.67) TTK
SCHEMBL470149 0.85 TTK (0.62) TTK
SCHEMBL470046 0.85 TTK (0.62) 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