SCHEMBL470336

SCHEMBL470336

Cc1cc(-c2cnc3c(NCC(F)F)cc(Br)nn23)ccc1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TTK P33981 17/20 0.42
FYN P06241 1/20 0.38
ERN1 O75460 1/20 0.37
HSP90AA1 P07900 1/20 0.37

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
SCHEMBL17416351 0.90 TTK (0.45) TTK
SCHEMBL17416362 0.88 TTK (0.46) TTK
SCHEMBL469957 0.85 TTK (0.55) TTK
SCHEMBL17590113 0.84 TTK (0.47) TTKFYNERN1HSP90AA1
SCHEMBL469970 0.84 TTK (0.50) TTK
SCHEMBL469943 0.82 TTK (0.52) TTKFYNERN1
SCHEMBL470101 0.82 TTK (0.53) TTKFYN
SCHEMBL469974 0.81 TTK (0.64) TTKFYN
SCHEMBL10279263 0.81 TTK (0.51) TTKFYNERN1
SCHEMBL470065 0.80 TTK (0.49) TTKFYNHSP90AA1

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