SCHEMBL470171

SCHEMBL470171

NC(=O)c1ccc(-c2cnc3c(NCC4CCOCC4)cc(Br)nn23)cc1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TTK P33981 17/20 0.60
FYN P06241 3/20 0.47

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
SCHEMBL469974 0.90 TTK (0.64) TTKFYN
SCHEMBL456437 0.89 TTK (0.77) TTK
SCHEMBL104544 0.84 TTK (0.81) TTK
SCHEMBL17416373 0.83 TTK (0.66) TTK
SCHEMBL17425421 0.81 TTK (0.78) TTK
SCHEMBL17416374 0.81 TTK (0.65) TTK
SCHEMBL469943 0.80 TTK (0.52) TTKFYN
SCHEMBL178466 0.80 TTK (0.77) TTK
SCHEMBL135281 0.79 TTK (0.88) TTK
SCHEMBL10279104 0.78 TTK (0.67) TTKFYN

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