SCHEMBL7997004

SCHEMBL7997004

Fc1ccc(-c2nc3cccccc-3c2-c2ccnc(F)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.48
MAPK13 O15264 2/20 0.48
MAPK12 P53778 2/20 0.48
MAPK11 Q15759 2/20 0.48
ADORA2B P29275 6/20 0.44
ADORA2A P29274 3/20 0.44
MAPK10 P53779 2/20 0.41
MAPT P10636 1/20 0.41
NQO2 P16083 2/20 0.40
TOP1 P11387 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
SCHEMBL7996541 0.83 ADORA2B (0.46) MAPK14MAPK13MAPK12MAPK11ADORA2B
SCHEMBL8000327 0.82 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11ADORA2B
SCHEMBL8000428 0.81 MAPK14 (0.54) MAPK14MAPK13MAPK12MAPK11ADORA2A
SCHEMBL7993156 0.74 AURKB (0.49) MAPK14MAPK13MAPK12MAPK11
SCHEMBL7982783 0.74 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL4101681 0.70 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11ADORA2B
SCHEMBL5378766 0.69 MAPK14 (0.72) MAPK14MAPK13MAPK12MAPK11ADORA2B
SCHEMBL7982929 0.68 TDP1 (0.45) MAPK14MAPK13MAPK12MAPK11ADORA2A
SCHEMBL21067592 0.68 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11ADORA2B
SCHEMBL7993062 0.68 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11ADORA2A

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-2001057018-A1 AZAAZULENE INHIBITORS OF P38 MAP KINASE AND TNF-ALPHA ABBOTT LABORATORIES (US) 2001-08-09 WO claimed
WO-2001057018-A1 AZAAZULENE INHIBITORS OF P38 MAP KINASE AND TNF-ALPHA ABBOTT LABORATORIES (US) 2001-08-09 WO disclosed