SCHEMBL4895523

SCHEMBL4895523

O=C(O)c1ncn2c1Cn1ncnc1-c1cc(OC(F)(F)F)ccc1-2

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 20/20 0.80
GABRB3 P28472 20/20 0.80
GABRA5 P31644 20/20 0.80

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
SCHEMBL3566638 0.89 GABRG2 (1.00) GABRG2GABRB3GABRA5
SCHEMBL3578536 0.87 GABRG2 (0.79) GABRG2GABRB3GABRA5
SCHEMBL4593227 0.85 GABRG2 (1.00) GABRG2GABRB3GABRA5
SCHEMBL4892858 0.83 GABRG2 (0.60) GABRG2GABRB3GABRA5
SCHEMBL3570896 0.83 GABRG2 (0.74) GABRG2GABRB3GABRA5
SCHEMBL3884039 0.82 GABRG2 (0.76) GABRG2GABRB3GABRA5
SCHEMBL3579571 0.81 GABRG2 (0.74) GABRG2GABRB3GABRA5
SCHEMBL3871120 0.81 GABRG2 (0.77) GABRG2GABRB3GABRA5
SCHEMBL3576913 0.81 GABRG2 (0.59) GABRG2GABRB3GABRA5
SCHEMBL4947515 0.79 GABRG2 (0.76) GABRG2GABRB3GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1809297-B1 IMIDAZO[1,5A]TRIAZOLO[1,5D]BENZODIAZEPINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE DISORDERS HOFFMANN LA ROCHE (CH) 2008-07-30 EP claimed
JP-2008515941-A 2008-05-15 JP claimed
EP-1809297-A1 IMIDAZO[1,5A]TRIAZOLO[1,5D]BENZODIAZEPINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE DISORDERS F. Hoffmann-Roche AG (CH) 2007-07-25 EP claimed
WO-2006040038-A1 IMIDAZO [1, 5-A]TRIAZOLO[1, 5-D]BENZODIAZEPINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE DISORDERS F.HOFFMANN-LA ROCHE AG (CH) 2006-04-20 WO claimed