SCHEMBL1665348

SCHEMBL1665348

O=C(Nc1ccc2c(ccn2CCO)c1)c1ccc(-n2ncc3cc(Nc4ccc(N5CCC(O)CC5)cc4)ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 2/20 0.42
MAPK10 P53779 11/20 0.42
MAPK8 P45983 9/20 0.42
MAPK13 O15264 3/20 0.42
MAPK12 P53778 3/20 0.42
MAPK11 Q15759 3/20 0.42
MAPK14 Q16539 3/20 0.42
MAOB P27338 1/20 0.40
PIN1 Q13526 1/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HTR1A P08908 1/20 0.37
HTR1B P28222 1/20 0.37
HTR1F P30939 1/20 0.37
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL1665351 0.97 MAOB (0.42) TNIKMAPK10MAPK8MAPK13MAPK12
SCHEMBL1666178 0.96 MAPK10 (0.41) TNIKMAPK10MAPK8MAPK13MAPK12
SCHEMBL1666179 0.94 MAOB (0.41) TNIKMAPK10MAPK8MAPK13MAPK12
SCHEMBL1664634 0.88 MAPK10 (0.51) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1666777 0.87 MAOB (0.44) TNIKMAPK10MAPK8MAPK13MAPK12
SCHEMBL1664637 0.87 RAB9A (0.45) TNIKMAPTKDM4ESMN1; SMN2USP2
SCHEMBL1663527 0.86 MAPK10 (0.40) TNIKMAPK10MAPK8MAPK13MAPK12
SCHEMBL1664636 0.86 RAB9A (0.45) TNIKMAOBMAPTHPGDSMN1; SMN2
SCHEMBL1665065 0.85 MAOB (0.47) TNIKMAPK10MAPK8MAPK13MAPK12
SCHEMBL1663342 0.85 MAOB (0.52) TNIKMAPK10MAPK8MAPK13MAPK12

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