SCHEMBL6928890

SCHEMBL6928890

O=C(Nc1n[nH]c2cc(Nc3ccccc3Cl)ccc12)c1ccoc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 9/20 0.55
MAPK10 P53779 9/20 0.55
MAPK14 Q16539 9/20 0.55
HDAC6 Q9UBN7 7/20 0.49
GSK3B P49841 2/20 0.46
GSK3A P49840 1/20 0.45
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
FGFR1 P11362 1/20 0.44
FGFR2 P21802 1/20 0.44
FGFR3 P22607 1/20 0.44

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
SCHEMBL6925889 0.83 MAPK8 (0.70) MAPK8MAPK10MAPK14HDAC6JAK2
SCHEMBL6929720 0.83 MAPK8 (0.53) MAPK8MAPK10MAPK14HDAC6GSK3A
SCHEMBL6924018 0.81 MAPK8 (0.56) MAPK8MAPK10MAPK14HDAC6JAK2
SCHEMBL6928888 0.79 GSK3A (0.64) MAPK8MAPK10MAPK14GSK3BGSK3A
SCHEMBL17028029 0.78 FGFR1 (0.48) MAPK8MAPK10HDAC6GSK3BGSK3A
SCHEMBL30495324 0.78 FGFR1 (0.48) MAPK8MAPK10HDAC6GSK3BGSK3A
SCHEMBL7134630 0.77 ULK1 (0.58) MAPK8MAPK10MAPK14GSK3BGSK3A
SCHEMBL22551182 0.76 FLT3 (0.56) MAPK8MAPK10MAPK14HDAC6FGFR1
SCHEMBL29568296 0.76 FLT3 (0.56) MAPK8MAPK10MAPK14HDAC6FGFR1
SCHEMBL6928950 0.75 ULK1 (0.51) MAPK8MAPK10MAPK14GSK3BGSK3A

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
WO-2004113303-A1 INDAZOLE/PYRZOLO[4,3-c]PYRIDIN DERIVATIVES AS JNK INHIBITORS, COMPOSITIONS AND METHODS RELATED THERETO AS WELL AS INTERMEDIATE THEREOF ASTRAZENECA AB (SE) 2004-12-29 WO claimed
WO-2004113303-A1 INDAZOLE/PYRZOLO[4,3-c]PYRIDIN DERIVATIVES AS JNK INHIBITORS, COMPOSITIONS AND METHODS RELATED THERETO AS WELL AS INTERMEDIATE THEREOF ASTRAZENECA AB (SE) 2004-12-29 WO disclosed