SCHEMBL16095944

SCHEMBL16095944

COC(CN=Cc1ncc2nccnc2n1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK3 O43781 1/20 0.32
CLK1 P49759 1/20 0.32
CLK2 P49760 1/20 0.32
CLK3 P49761 1/20 0.32
GSK3B P49841 1/20 0.32
DYRK1A Q13627 1/20 0.32
DYRK2 Q92630 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
DYRK4 Q9NR20 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
MET P08581 1/20 0.31

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
SCHEMBL16096209 0.89 MEN1 (0.31) MEN1KMT2ATAAR1
SCHEMBL16099271 0.80 MEN1 (0.38) DYRK3CLK1CLK2CLK3GSK3B
SCHEMBL16095805 0.79 MEN1 (0.36) DYRK3CLK1CLK2CLK3GSK3B
SCHEMBL16097183 0.75 MEN1 (0.36) DYRK3CLK1CLK2CLK3GSK3B
SCHEMBL16095533 0.74 MEN1 (0.34) DYRK3CLK1CLK2CLK3GSK3B
SCHEMBL16097058 0.73 MEN1 (0.37) CLK2GSK3BDYRK1ACLK4DYRK1B
SCHEMBL16097061 0.73 MEN1 (0.37) CLK2GSK3BDYRK1ACLK4DYRK1B
SCHEMBL16097757 0.72 MAOA (0.44) MEN1KMT2ATAAR1
SCHEMBL16095943 0.71 MEN1 (0.37) CLK4MEN1KMT2ATAAR1
SCHEMBL16096005 0.71 MEN1 (0.43) DYRK3CLK1CLK2CLK3GSK3B

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969593-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORP (JP) 2020-11-04 EP disclosed
US-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed
EP-2969593-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES Bridgestone Corporation (JP) 2016-01-20 EP disclosed
WO-2014149931-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORPORATION (JP) 2014-09-25 WO disclosed