SCHEMBL462359

SCHEMBL462359

Cc1c(C(N)=O)ccc(-c2cnc3c(NCC(F)(F)F)cc(Oc4cccc(F)c4)nn23)c1C1CC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TTK P33981 14/20 0.42
MAPK10 P53779 4/20 0.37
MAPK8 P45983 2/20 0.37
USP2 O75604 1/20 0.35
KMT2A Q03164 1/20 0.35
SYK P43405 1/20 0.35

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
SCHEMBL12468487 0.86 TTK (0.38) TTKMAPK10MAPK8SYK
SCHEMBL462242 0.85 USP2 (0.34) TTKUSP2KMT2ASYK
SCHEMBL462654 0.84 PDE4A (0.36) TTKUSP2KMT2ASYK
SCHEMBL462101 0.81 TTK (0.42) TTKMAPK10MAPK8
SCHEMBL15560602 0.79 TTK (0.54) TTK
SCHEMBL463364 0.78 TTK (0.40) TTKMAPK10MAPK8
SCHEMBL461869 0.78 TTK (0.55) TTKSYK
SCHEMBL462358 0.78 TTK (0.67) TTK
SCHEMBL463164 0.78 TTK (0.50) TTK
SCHEMBL456407 0.77 TTK (0.60) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2614063-A1 SUBSTITUTED IMIDAZOPYRIDAZINES Bayer Intellectual Property GmbH (DE) 2013-07-17 EP claimed
WO-2012032031-A1 SUBSTITUTED IMIDAZOPYRIDAZINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-15 WO claimed