SCHEMBL7564476

SCHEMBL7564476

CCc1c(Br)cc2[nH]c(=O)c(=O)[nH]c2c1CN(C)CC(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 4/20 1.00
GRIA2 P42262 4/20 1.00
GRIA3 P42263 4/20 1.00
GRIA4 P48058 4/20 1.00
GRIN1 Q05586 7/20 0.41
HIF1A Q16665 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GRIN2D O15399 3/20 0.38
GRIN3B O60391 3/20 0.38
GRIN2A Q12879 3/20 0.38
GRIN2B Q13224 3/20 0.38
GRIN2C Q14957 3/20 0.38
GRIN3A Q8TCU5 3/20 0.38

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
SCHEMBL7566351 0.85 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIN1
Hydrochloric Acid SCHEMBL7566781 0.84 GRIA1 (0.98) GRIA1GRIA2GRIA3GRIA4GRIN1
SCHEMBL8636235 0.83 GRIA1 (0.83) GRIA1GRIA2GRIA3GRIA4GRIN1
SCHEMBL7571587 0.81 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIN1
Ammonia Solution, Strong SCHEMBL7591992 0.81 GRIA1 (0.98) GRIA1GRIA2GRIA3GRIA4GRIN1
SCHEMBL7573065 0.79 GRIA1 (0.65) GRIA1GRIA2GRIA3GRIA4GRIN1
SCHEMBL9233148 0.75 GRIA1 (0.60) GRIA1GRIA2GRIA3GRIA4GRIN1
SCHEMBL8638991 0.72 GRIA1 (0.56) GRIA1GRIA2GRIA3GRIA4GRIN1
SCHEMBL9233161 0.72 GRIA1 (0.57) GRIA1GRIA2GRIA3GRIA4GRIN1
SCHEMBL7569079 0.69 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832074-B1 AMINO ACID DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONE DERIVATIVES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 2002-09-04 EP claimed
EP-0832074-A1 AMINO ACID DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONE DERIVATIVES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-04-01 EP claimed
WO-1996040649-A1 AMINO ACID DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONE DERIVATIVES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1996-12-19 WO claimed
EP-0832074-B1 AMINO ACID DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONE DERIVATIVES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 2002-09-04 EP disclosed
US-5614508-A ANTIISCHEMIC AGENTS, ALZHEIMERS, STROKE OR NERVOUS SYSTEM DISORDERS WARNER-LAMBERT COMPANY (US) 1997-03-25 US disclosed
WO-1996040649-A1 AMINO ACID DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONE DERIVATIVES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1996-12-19 WO disclosed