SCHEMBL8565114

SCHEMBL8565114

CS(=O)(=O)c1ccc(-c2nc3ccccn3c2-c2ccc(F)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 11/20 0.62
PTGS1 P23219 1/20 0.62
ALDH1A1 P00352 2/20 0.54
NR1I3 Q14994 1/20 0.54
KDM4E B2RXH2 1/20 0.52
HPGD P15428 1/20 0.52
MAPK13 O15264 1/20 0.48
MAPK12 P53778 1/20 0.48
MAPK11 Q15759 1/20 0.48
MAPK14 Q16539 1/20 0.48
HTR6 P50406 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL7217081 1.00 PTGS2 (0.62) PTGS2PTGS1ALDH1A1NR1I3KDM4E
SCHEMBL7218055 0.91 PTGS2 (0.64) PTGS2PTGS1NR1I3HDAC6
SCHEMBL7222836 0.88 ALDH1A1 (0.54) PTGS2PTGS1ALDH1A1KDM4EHPGD
SCHEMBL7221860 0.85 PTGS2 (0.71) PTGS2PTGS1ALDH1A1NR1I3KDM4E
SCHEMBL22342526 0.84 ALDH1A1 (0.61) ALDH1A1NR1I3KDM4EHPGDMAPK13
SCHEMBL7218478 0.83 PTGS2 (0.60) PTGS2PTGS1ALDH1A1KDM4EHPGD
SCHEMBL22342529 0.83 ALDH1A1 (0.57) ALDH1A1NR1I3KDM4EHPGDMAPK13
SCHEMBL7216602 0.82 PTGS2 (0.56) PTGS2PTGS1ALDH1A1NR1I3KDM4E
SCHEMBL7217160 0.82 PTGS2 (0.56) PTGS2PTGS1ALDH1A1NR1I3KDM4E
SCHEMBL7216551 0.82 PTGS2 (0.52) PTGS2PTGS1NR1I3

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
EP-0819127-A1 IMIDAZO [1,2-a]PYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1998-01-21 EP disclosed
WO-1996031509-A1 IMIDAZO[1,2-a]PYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1996-10-10 WO disclosed