SCHEMBL2660593

SCHEMBL2660593

CC(C)(O)c1ccn2c(-c3ccnc(-c4ccc(F)c(Cl)c4)n3)cnc2c1F

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 10/20 0.50
GABRG2 P18507 10/20 0.50
GABRB3 P28472 10/20 0.50
GABRA3 P34903 10/20 0.50
KMO O15229 1/20 0.38
GABRA5 P31644 7/20 0.38
GABRA2 P47869 1/20 0.36
MAPK9 P45984 4/20 0.36
MC4R P32245 1/20 0.35
DYRK1A Q13627 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
KDR P35968 1/20 0.33
FLT3 P36888 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL2659604 0.92 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRA3KMO
SCHEMBL2660454 0.91 GABRA1 (0.52) GABRA1GABRG2GABRB3GABRA3KMO
SCHEMBL5430437 0.90 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL2659070 0.87 GABRA1 (0.63) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL5384206 0.86 GABRA1 (0.61) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL5396362 0.85 GABRA1 (0.51) GABRA1GABRG2GABRB3GABRA3KMO
SCHEMBL2660756 0.85 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL2658731 0.84 GABRA1 (0.47) GABRA1GABRG2GABRB3GABRA3KMO
SCHEMBL2659968 0.84 GABRA1 (0.59) GABRA1GABRG2GABRB3GABRA3GABRA5
SCHEMBL2658470 0.82 GABRA1 (0.66) 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 5 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-A1 8-FLUORIMIDAZO(1,2-A)PYRIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LTD. (GB) 2005-03-09 EP claimed
WO-2003099817-A1 8-FLUORIMIDAZO`1,2-A!PYRIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2003-12-04 WO 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