SCHEMBL8533969

SCHEMBL8533969

CN1Cc2c(-c3ccc([N+](=O)[O-])cc3)cc3[nH]c(=O)c(=O)[nH]c3c2C1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 6/20 0.56
GRIA2 P42262 6/20 0.56
GRIA3 P42263 6/20 0.56
GRIA4 P48058 6/20 0.56
SMN1; SMN2 Q16637 1/20 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
SCHEMBL8798182 0.82 GRIA1 (0.47) GRIA1GRIA2GRIA3GRIA4
SCHEMBL7103934 0.78 GRIA1 (0.81) GRIA1GRIA2GRIA3GRIA4
SCHEMBL14287158 0.73 GRIA1 (0.58) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8537048 0.73 GRIA1 (0.58) GRIA1GRIA2GRIA3GRIA4
SCHEMBL29798454 0.72 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4
SCHEMBL678318 0.72 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6787042 0.69 GRIA1 (0.52) GRIA1GRIA2GRIA3GRIA4SMN1; SMN2
SCHEMBL6785459 0.69 GRIA1 (0.57) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6780551 0.69 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4
SCHEMBL7959740 0.67 GRIA1 (0.87) GRIA1GRIA2GRIA3GRIA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5843945-A AMPA antagonists and a method of treatment NEUROSEARCH A/S (DK) 1998-12-01 US claimed
US-5843945-A AMPA antagonists and a method of treatment NEUROSEARCH A/S (DK) 1998-12-01 US disclosed
US-5780493-A TREATING BRAIN DISORDERS NEUROSEARCH A/S (DK) 1998-07-14 US disclosed