SCHEMBL469990

SCHEMBL469990

Cc1ccccc1Oc1cc(NCCCO)c2ncc(-c3ccc(C(N)=O)c(C)c3)n2n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TTK P33981 17/20 0.51
FYN P06241 3/20 0.43

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
SCHEMBL10279720 0.91 TTK (0.52) TTKFYN
SCHEMBL17425418 0.90 TTK (0.54) TTKFYN
SCHEMBL470099 0.86 TTK (0.53) TTKFYN
SCHEMBL470149 0.83 TTK (0.62) TTK
SCHEMBL470046 0.83 TTK (0.62) TTK
SCHEMBL17590109 0.82 TTK (0.56) TTKFYN
SCHEMBL10279126 0.82 TTK (0.54) TTK
SCHEMBL17590111 0.81 TTK (0.54) TTKFYN
SCHEMBL470084 0.81 TTK (0.64) TTK
SCHEMBL17590106 0.81 TTK (0.58) 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