SCHEMBL28040296

SCHEMBL28040296

COC(CN=Cc1ccn(C)n1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
TSHR P16473 1/20 0.31
DYRK3 O43781 1/20 0.31
CLK1 P49759 1/20 0.31
CLK2 P49760 1/20 0.31
CLK3 P49761 1/20 0.31
GSK3B P49841 1/20 0.31
DYRK1A Q13627 1/20 0.31
DYRK2 Q92630 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
DYRK4 Q9NR20 1/20 0.31
DYRK1B Q9Y463 1/20 0.31
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
FYN P06241 1/20 0.30

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
SCHEMBL17499789 0.78 MEN1 (0.34) KMT2AMEN1TAAR1DYRK3CLK1
SCHEMBL16097757 0.77 MAOA (0.44) KMT2AMEN1TAAR1SMN1; SMN2
SCHEMBL17499115 0.76 KDM4E (0.40) KMT2AMEN1TAAR1DYRK3CLK1
SCHEMBL28039852 0.75 MET (0.42) KMT2AMEN1TAAR1DYRK3CLK1
SCHEMBL16097678 0.74 MEN1 (0.34) KMT2AMEN1TAAR1DYRK3CLK1
SCHEMBL16095533 0.74 MEN1 (0.34) KMT2AMEN1TAAR1DYRK3CLK1
SCHEMBL16104945 0.74 MEN1 (0.34) KMT2AMEN1TAAR1DYRK3CLK1
SCHEMBL28039870 0.74 MET (0.42) KMT2AMEN1TAAR1DYRK3CLK1
SCHEMBL16098722 0.74 MEN1 (0.34) KMT2AMEN1TAAR1DYRK3CLK1
SCHEMBL16099271 0.73 MEN1 (0.38) KMT2AMEN1TAAR1DYRK3CLK1

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
CN-105209268-A Heterocyclic imine functionalized polymers BRIDGESTONE CORP 2015-12-30 CN disclosed