SCHEMBL8564918

SCHEMBL8564918

Cc1cccn2c(-c3ccc(F)cc3)c(-c3ccc(S(C)(=O)=O)cc3)nc12

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 18/20 0.60
PTGS1 P23219 2/20 0.60
ALOX5 P09917 1/20 0.48
AKT1 P31749 1/20 0.48
AKT2 P31751 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
SCHEMBL8560259 0.89 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL8564646 0.87 PTGS2 (0.58) PTGS2PTGS1AKT1AKT2
SCHEMBL8600540 0.86 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL8564319 0.85 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL8566479 0.85 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL8568965 0.85 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL213843 0.84 PTGS2 (0.58) PTGS2PTGS1AKT1AKT2
SCHEMBL8562195 0.84 PTGS2 (0.55) PTGS2PTGS1AKT1AKT2
SCHEMBL8563504 0.83 PTGS2 (0.54) PTGS2PTGS1
SCHEMBL8566547 0.82 AKT1 (0.55) PTGS2PTGS1AKT1AKT2

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