SCHEMBL1663940

SCHEMBL1663940

O=C(Nc1ccc2c(cnn2-c2ccc(NCCCN3CCOCC3)cc2)c1)c1ccc(N2CCOCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 10/20 0.63
MAPK8 P45983 7/20 0.63
MAPK14 Q16539 5/20 0.63
MAPK13 O15264 4/20 0.63
MAPK12 P53778 4/20 0.63
MAPK11 Q15759 4/20 0.63
MAPT P10636 4/20 0.48
KDM4E B2RXH2 1/20 0.48
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
AR P10275 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
RECQL P46063 1/20 0.47
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
CHRNA7 P36544 1/20 0.46
KCNH2 Q12809 1/20 0.46
KMT2A Q03164 1/20 0.46
ATM Q13315 1/20 0.45

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
SCHEMBL1664913 0.88 MAPT (0.59) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL13836623 0.88 MAPK10 (0.56) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL13974467 0.87 MAPK10 (0.58) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL8769687 0.87 MAPT (0.54) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL1665410 0.87 MAPT (0.52) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL13974299 0.84 MAPT (0.49) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL1664427 0.84 ALDH1A1 (0.52) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL1664065 0.84 MAPT (0.54) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL8771404 0.84 MAPT (0.67) MAPK10MAPK8MAPK14MAPK13MAPK12
SCHEMBL1664312 0.83 MAPK10 (0.59) MAPK10MAPK8MAPK14MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2642994-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS Ligand Pharmaceuticals Incorporated (US) 2013-10-02 EP disclosed
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed