SCHEMBL1665684

SCHEMBL1665684

O=C(NCC1CC1)c1ccc(-n2ncc3cc(Nc4ccc(N5CCC(O)CC5)cc4)ccc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 13/20 0.48
MAPK8 P45983 10/20 0.48
MAPK13 O15264 2/20 0.48
MAPK12 P53778 2/20 0.48
MAPK11 Q15759 2/20 0.48
MAPK14 Q16539 2/20 0.48
TNIK Q9UKE5 1/20 0.43
SMO Q99835 1/20 0.42
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 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
SCHEMBL1665685 0.93 MAPK14 (0.45) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1666175 0.88 JAK2 (0.53) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1664510 0.87 SMO (0.54) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1663342 0.84 MAOB (0.52) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1664474 0.83 TNIK (0.46) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1666461 0.83 MAPT (0.50) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1663875 0.82 TDP1 (0.47) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL6126509 0.81 SMN1; SMN2 (0.45) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1664292 0.81 TNIK (0.46) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1666176 0.81 JAK2 (0.49) MAPK10MAPK8MAPK13MAPK12MAPK11

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