SCHEMBL678318

SCHEMBL678318

CN1CCc2c([N+](=O)[O-])cc3[nH]c(=O)c(=O)[nH]c3c2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 5/20 1.00
GRIA2 P42262 5/20 1.00
GRIA3 P42263 5/20 1.00
GRIA4 P48058 5/20 1.00

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
SCHEMBL29798454 1.00 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6780551 0.95 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4
SCHEMBL7959740 0.93 GRIA1 (0.87) GRIA1GRIA2GRIA3GRIA4
SCHEMBL7103934 0.89 GRIA1 (0.81) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8810839 0.88 GRIA1 (0.87) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6784577 0.84 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6785878 0.79 GRIA1 (0.88) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6783780 0.79 GRIA1 (0.66) GRIA1GRIA2GRIA3GRIA4
SCHEMBL6791392 0.79 GRIA1 (0.64) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8684519 0.78 GRIA1 (0.64) 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 103 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011076946-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF ALZHEIMER Universidad Del País Vasco (ES) 2011-06-30 WO claimed
US-20080113969-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN CREDIT SUISSE AG 2008-05-15 US claimed
US-20080108603-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. 2008-05-08 US claimed
US-20080108622-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN CREDIT SUISSE AG 2008-05-08 US claimed
US-7192931-B2 Treatment of demyelinating diseases NEUREN PHARMACEUTICALS LTD. (NZ) 2007-03-20 US claimed
WO-2004069195-A2 METHODS AND COMPOSITIONS FOR TREATING INFLAMMATORY DISORDERS OF THE AIRWAYS IVAX CORPORATION (US) 2004-08-19 WO claimed
US-20040152694-A1 Methods and compositions for treating inflammatory disorders of the airways IVAX DRUG RESEARCH INSTITUTE, LTD. 2004-08-05 US claimed
US-20040053850-A1 Treatment of demyelinating diseases ENDOCRINZ LIMITED (NZ) 2004-03-18 US claimed
US-6703391-B2 THROMBOSIS, BRAIN DISORDERS, CARDIOVASCULAR DISORDERS, ALZHEIMER'S DISEASE, HUNTINGTON DISEASES NEUROSEARCH A/S (DK) 2004-03-09 US claimed
EP-1359933-A2 TREATMENT OF DEMYELINATING DISEASES BY ADMINISTERING GPE Neuronz Limited (NZ) 2003-11-12 EP claimed
US-20030114422-A1 NOVEL QUINOXALINEDIONE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 2003-06-19 US claimed
WO-2002030447-A2 TREATMENT OF DEMYELINATING DISEASES BY ADMINISTERING GPE NEURONZ LTD. (NZ) 2002-04-18 WO claimed
WO-2002030448-A2 TREATMENT OF DEMYELINATING DISEASES BY ADMINISTERING GPE NEURONZ LTD. (NZ) 2002-04-18 WO claimed
EP-0664807-B1 QUINOXALINEDIONE DERIVATIVES AS EAA ANTAGONISTS WARNER LAMBERT CO (US) 1997-09-10 EP claimed
EP-0664807-A1 QUINOXALINEDIONE DERIVATIVES AS EAA ANTAGONISTS. WARNER LAMBERT CO (US) 1995-08-02 EP claimed
WO-1994009000-A1 QUINOXALINEDIONE DERIVATIVES AS EAA ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1994-04-28 WO claimed
US-20250288544-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS PARIS SCIENCES ET LETTRES - QUARTIER LATIN (FR) 2025-09-18 US disclosed
US-12318358-B2 Probenecid for use in treating epileptic diseases, disorders or conditions PARIS SCIENCES ET LETTRES (FR) 2025-06-03 US disclosed
EP-0664807-A1 QUINOXALINEDIONE DERIVATIVES AS EAA ANTAGONISTS. WARNER LAMBERT CO (US) 1995-08-02 EP disclosed
WO-1994009000-A1 QUINOXALINEDIONE DERIVATIVES AS EAA ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1994-04-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030114422-A1 NOVEL QUINOXALINEDIONE DERIVATIVES, THEIR PREPARATION AND USE CHRNA3, CHRNA7, CHRNB3 GRIA1 41/4885GRIA2 25/4885GRIA3 16/4885
US-20250288544-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS NLN, CLN6, SLC1A2 GRIA1 346/4885GRIA2 127/4885GRIA3 170/4885
US-20080113969-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN ADORA1, ADORA3, OPRL1 GRIA1 73/4885GRIA2 109/4885GRIA3 69/4885
US-20080108603-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN ADORA1, ADORA3, OPRL1 GRIA1 73/4885GRIA2 109/4885GRIA3 69/4885
US-20040152694-A1 Methods and compositions for treating inflammatory disorders of the airways LTB4R2, LTB4R, LTC4S GRIA1 2085/4885GRIA2 2341/4885GRIA3 2201/4885
US-20080108622-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN ADORA1, ADORA3, OPRL1 GRIA1 73/4885GRIA2 109/4885GRIA3 69/4885
US-12318358-B2 Probenecid for use in treating epileptic diseases, disorders or conditions NLN, CLN6, SLC1A2 GRIA1 346/4885GRIA2 127/4885GRIA3 170/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.