SCHEMBL11038245

SCHEMBL11038245

CCc1cc2c(cc1CC)CC(=O)NC=C2

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 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
SCHEMBL7951439 0.85 GAA (0.48) GAA
SCHEMBL9214465 0.79 GAA (0.55) GAA
SCHEMBL11041593 0.78 GAA (0.51) GAA
SCHEMBL7951440 0.78 GAA (0.44) GAA
SCHEMBL8268993 0.75 GAA (0.51) GAA
SCHEMBL9214873 0.75 GAA (0.48) GAA
SCHEMBL333847 0.75 GAA (0.63) GAAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL15906664 0.70 GAA (0.57) GAA
SCHEMBL11038801 0.69
SCHEMBL5044573 0.69 GAA (0.60) GAA

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
EP-0116444-A2 Improvements in or relating to benzazepine derivatives ELI LILLY AND COMPANY (US) 1984-08-22 EP disclosed