SCHEMBL7466967

SCHEMBL7466967

Cc1ccc([N+](=O)[O-])c(NCN)c1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 4/20 0.71
TSHR P16473 2/20 0.55
CYP3A4 P08684 1/20 0.55
GRK6 P43250 2/20 0.50
MAPT P10636 5/20 0.49
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
HTR6 P50406 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL981242 0.85 KAT2B (0.64) KAT2BTSHRCYP3A4GRK6MAPT
SCHEMBL14981759 0.84 KAT2B (0.97) KAT2BTSHRCYP3A4MAPT
Hydrochloric Acid SCHEMBL513348 0.83 KAT2B (1.00) KAT2BTSHRCYP3A4MAPT
SCHEMBL978709 0.82 TSHR (0.62) KAT2BTSHRCYP3A4GRK6MAPT
SCHEMBL3636228 0.82 KAT2B (0.69) KAT2BTSHRCYP3A4GRK6MAPT
SCHEMBL9081742 0.81 TSHR (0.60) KAT2BTSHRCYP3A4GRK6MAPT
SCHEMBL17263168 0.81 KAT2B (0.59) KAT2BTSHRCYP3A4GRK6MAPT
SCHEMBL15082923 0.81 MAPT (0.61) KAT2BTSHRCYP3A4GRK6MAPT
SCHEMBL24185371 0.78 KAT2B (0.64) KAT2BTSHRCYP3A4MAPTHTR6
SCHEMBL22725388 0.78 KAT2B (0.57) KAT2BTSHRCYP3A4GRK6MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0837854-B1 ALKYL AMINE DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 2002-12-11 EP disclosed
EP-0830348-B1 CYCLIC AMINE DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 2002-09-04 EP disclosed
US-6110911-A ADMINISTERING NEUROPROTECTANT/ANTICONVULSANT TO PATIENT WARNER-LAMBERT COMPANY (US) 2000-08-29 US disclosed
US-5874426-A USEFUL IN THE TREATMENT OF STROKE, CEREBRAL ISCHEMIA, OR CEREBRAL INFARCTION RESULTING FROM THROMBOEMBOLIC OR HEMORRHAGIC STROKE, CEREBRAL VASOSPASMS, HYPOGLYCEMIA, CARDIAC ARREST, STATUS EPILEPTICUS, ANOXIA, SEIZURE DISORDER WARNER-LAMBERT COMPANY (US) 1999-02-23 US disclosed
EP-0837854-A1 ALKYL AMINE DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-04-29 EP disclosed
EP-0830348-A1 CYCLIC AMINE DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-03-25 EP disclosed
US-5654303-A FOR TREATING NERVOUS SYSTEM OR CARDIOVASCULAR SYSTEM DISORDERS WARNER-LAMBERT COMPANY (US) 1997-08-05 US disclosed
WO-1996040650-A1 CYCLIC AMINE DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1996-12-19 WO disclosed
WO-1996040651-A1 ALKYL AMINE DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1996-12-19 WO disclosed