SCHEMBL5396362

SCHEMBL5396362

CC(C)(O)c1ccn2c(-c3ccnc(-c4cc(Cl)ccc4F)n3)cnc2c1F

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 13/20 0.51
GABRG2 P18507 13/20 0.51
GABRB3 P28472 13/20 0.51
GABRA3 P34903 13/20 0.51
GABRA5 P31644 9/20 0.38
GABRA2 P47869 3/20 0.37
MAPK9 P45984 4/20 0.37
FLT3 P36888 2/20 0.33
KMO O15229 1/20 0.32

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
SCHEMBL2660756 0.91 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL5430437 0.87 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL2660593 0.85 GABRA1 (0.50) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL2659945 0.85 GABRA1 (0.47) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL5738295 0.84 GABRA1 (0.47) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL2660454 0.84 GABRA1 (0.52) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL5391496 0.84 GABRA1 (0.50) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL2659604 0.83 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL2660285 0.83 GABRA1 (0.71) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL5380990 0.79 GABRA1 (0.54) GABRA1GABRG2GABRB3GABRA3GABRA5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7226926-B2 8-fluoroimidazo 1,2-a pyridine derivatives as ligands for GABA receptors MERCK SHARP & DOHME LTD. (GB) 2007-06-05 US claimed
EP-1511748-B1 8-FLUORIMIDAZO(1,2-A)PYRIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME (GB) 2006-08-09 EP claimed
EP-1511748-B1 8-FLUORIMIDAZO(1,2-A)PYRIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME (GB) 2006-08-09 EP disclosed