SCHEMBL10279099

SCHEMBL10279099

Cc1cc(-c2cnc3c(NCC4CCSCC4)cc(Sc4cccc(O)c4)nn23)ccc1C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TTK P33981 15/20 0.47
FYN P06241 2/20 0.41
IKBKB O14920 1/20 0.40
ERN1 O75460 2/20 0.38

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
SCHEMBL470143 0.93 TTK (0.48) TTKFYNIKBKBERN1
SCHEMBL470139 0.93 TTK (0.47) TTKFYNIKBKB
SCHEMBL456228 0.92 TTK (0.58) TTK
SCHEMBL10279710 0.88 TTK (0.47) TTKFYNIKBKBERN1
SCHEMBL470152 0.87 TTK (0.46) TTKIKBKB
SCHEMBL455452 0.85 TTK (0.60) TTK
SCHEMBL459287 0.85 TTK (0.58) TTK
SCHEMBL470034 0.84 TTK (0.47) TTKFYNIKBKBERN1
SCHEMBL470045 0.84 TTK (0.46) TTKFYNIKBKB
SCHEMBL470042 0.84 TTK (0.52) 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