SCHEMBL8566608

SCHEMBL8566608

CCN(CC)Cc1cc([N+](=O)[O-])cc2[nH]c(=O)c(=O)[nH]c12

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 1/20 0.53

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
Bromide SCHEMBL8087047 0.99
SCHEMBL8498398 0.87 GRIN1 (0.52) GRIN1
Bromide SCHEMBL5979947 0.87 GRIN1 (0.58) GRIN1
SCHEMBL8500968 0.87 GRIN1 (0.51) GRIN1
SCHEMBL5973275 0.86 GRIN1 (0.57) GRIN1
SCHEMBL8562825 0.86 GRIN1 (0.55) GRIN1
Bromide SCHEMBL8092139 0.85 GRIN1 (0.54) GRIN1
SCHEMBL8501850 0.84 GRIN1 (0.51) GRIN1
SCHEMBL8570641 0.84 GRIN1 (0.51) GRIN1
SCHEMBL8570699 0.84

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-0853617-A1 NOVEL 2,3-DIOXO-1,2,3,4-TETRAHYDRO-QUINOYXALINYL DERIVATIVES Novartis AG (CH) 1998-07-22 EP claimed
WO-1997008155-A1 NOVEL 2,3-DIOXO-1,2,3,4-TETRAHYDRO-QUINOYXALINYL DERIVATIVES NOVARTIS AG (CH) 1997-03-06 WO claimed