SCHEMBL7355146

SCHEMBL7355146

CC1CC(=O)c2c(SC(N)=O)ccc(-c3nccs3)c2C1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 14/20 0.70
GABRB3 P28472 14/20 0.70
GABRA5 P31644 14/20 0.70
GABRA3 P34903 14/20 0.70
GABRA2 P47869 14/20 0.70
GABRA1 P14867 13/20 0.70
EEF2K O00418 1/20 0.33
LRRK2 Q5S007 1/20 0.32
GABRG3 Q99928 1/20 0.32
STAT3 P40763 1/20 0.32
ADORA2A P29274 1/20 0.30
ADORA2B P29275 1/20 0.30
ADORA1 P30542 1/20 0.30
CHEK2 O96017 1/20 0.30
HCRTR1 O43613 2/20 0.30
HCRTR2 O43614 2/20 0.30

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
SCHEMBL7355615 0.85 GABRG2 (0.78) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7349707 0.83 GABRG2 (1.00) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7358312 0.81 GABRG2 (0.73) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7359714 0.81 GABRG2 (0.67) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7358343 0.78 GABRG2 (0.76) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7353570 0.78 GABRG2 (0.72) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7350948 0.78 GABRG2 (0.58) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7355336 0.78 GABRG2 (0.58) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7359709 0.77 GABRG2 (0.69) GABRG2GABRB3GABRA5GABRA3GABRA2
SCHEMBL7351801 0.76 GABRG2 (0.72) GABRG2GABRB3GABRA5GABRA3GABRA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6156761-A Substituted tetralone derivatives for enhancing cognition MERCK SHARPE & DOHME LIMITED (GB) 2000-12-05 US disclosed