SCHEMBL8777699

SCHEMBL8777699

NC(=O)c1ccc(-n2ncc3cc(NC(=O)c4ccc(N5CCC(O)CC5)cc4)ccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 1/20 0.51
MAOB P27338 1/20 0.47
MAPK10 P53779 6/20 0.43
MAPK8 P45983 5/20 0.43
SYK P43405 2/20 0.42
MAPK13 O15264 2/20 0.41
MAPK12 P53778 2/20 0.41
MAPK11 Q15759 2/20 0.41
MAPK14 Q16539 2/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 1/20 0.41
SIRT2 Q8IXJ6 3/20 0.41
SIRT1 Q96EB6 3/20 0.41
SIRT3 Q9NTG7 3/20 0.41
HTR1A P08908 1/20 0.41
HTR1B P28222 1/20 0.41
HTR1F P30939 1/20 0.41
NPC1 O15118 2/20 0.40

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
SCHEMBL1663848 0.92 TNIK (0.47) TNIKMAOBMAPK10MAPK8MAPK13
SCHEMBL27918370 0.91 TNIK (0.46) TNIKMAOBMAPK10MAPK8SYK
SCHEMBL1663344 0.90 MAOB (0.56) TNIKMAOBMAPK10MAPK8MAPK13
SCHEMBL27936958 0.90 TNIK (0.47) TNIKMAOBMAPK10MAPK8SYK
SCHEMBL1666463 0.90 MAPT (0.52) TNIKMAOBMAPK10MAPK8MAPK13
SCHEMBL8771617 0.90 MGLL (0.46) TNIKMAOBMAPK10MAPK8MAPK13
SCHEMBL1664924 0.90 MAOB (0.46) TNIKMAOBMAPK10MAPK8SYK
SCHEMBL27937054 0.89 TNIK (0.46) TNIKMAOBMAPK10MAPK8SYK
SCHEMBL28946999 0.89 TNIK (0.47) TNIKMAOBMAPK10MAPK8SYK
SCHEMBL1665595 0.89 ABL1 (0.48) TNIKMAOBMAPK10MAPK8MAPK13

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
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed