SCHEMBL1665266

SCHEMBL1665266

O=C(O)NC1CCN(C(=O)c2ccc(-n3ncc4cc(Nc5ccc(N6CCC(O)CC6)cc5)ccc43)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.45
MAPK1 P28482 2/20 0.43
MBTD1 Q05BQ5 1/20 0.39
TP53BP1 Q12888 1/20 0.39
L3MBTL4 Q8NA19 1/20 0.39
L3MBTL3 Q96JM7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 1/20 0.39
SYK P43405 2/20 0.39
MAPK8 P45983 4/20 0.38
MAPK10 P53779 4/20 0.38
MAPK14 Q16539 3/20 0.38
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
KHK P50053 1/20 0.38
TNIK Q9UKE5 1/20 0.38
EPHX1 P07099 1/20 0.37
NAMPT P43490 1/20 0.37
HPGDS O60760 1/20 0.37

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
SCHEMBL1665270 0.92 MGLL (0.43) MGLLMAPK1HPGDMAPK8MAPK10
SCHEMBL1664246 0.84 SYK (0.44) MGLLMAPK1SYKMAPK8MAPK10
SCHEMBL8771617 0.84 MGLL (0.46) MGLLMBTD1TP53BP1L3MBTL4L3MBTL3
SCHEMBL6126221 0.84 MGLL (0.41) MGLLMAPK1MBTD1TP53BP1L3MBTL4
SCHEMBL1664251 0.81 MAOB (0.45) MAPK1HPGDMAPK8MAPK10MAPK14
SCHEMBL1664474 0.81 TNIK (0.46) L3MBTL1HPGDMAPK8MAPK10MAPK14
SCHEMBL8773474 0.81 NAMPT (0.47) MGLLMAPK8MAPK10MAPK14MAPK13
SCHEMBL1665009 0.80 TNIK (0.44) MGLLMAPK1MBTD1TP53BP1L3MBTL4
SCHEMBL1663875 0.80 TDP1 (0.47) MAPK1L3MBTL1HPGDMAPK8MAPK10
SCHEMBL1663342 0.80 MAOB (0.52) MGLLHPGDMAPK8MAPK10MAPK14

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-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed