SCHEMBL4694392

SCHEMBL4694392

Cc1sc2c(CC=O)cccc2c1Br

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.40
GABRB2 P47870 2/20 0.40

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
SCHEMBL4689929 0.76 GABRA1 (0.37) GABRA1GABRB2
SCHEMBL10432656 0.72 PSMB8 (0.36) GABRA1GABRB2
SCHEMBL4619300 0.71 GABRA1 (0.45) GABRA1GABRB2
SCHEMBL4690679 0.69 GABRA1 (0.40) GABRA1GABRB2
SCHEMBL3962564 0.68 PDE10A (0.41)
SCHEMBL1701340 0.67 GABRA1 (0.40) GABRA1GABRB2
SCHEMBL1759301 0.67 PARP1 (0.40) GABRA1GABRB2
SCHEMBL4690928 0.67
SCHEMBL3962703 0.67 CA2 (0.41) GABRA1GABRB2
SCHEMBL13263824 0.66 GABRA1 (0.43) GABRA1GABRB2

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-1879896-A1 IMIDAZOPYRIDAZINE COMPOUNDS ELI LILLY AND COMPANY (US) 2008-01-23 EP disclosed
WO-2006107784-A1 IMIDAZOPYRIDAZINE COMPOUNDS ELI LILLY AND COMPANY (US) 2006-10-12 WO disclosed