SCHEMBL600372

SCHEMBL600372

CN(C)C(=O)Cc1nn(-c2ccccc2)c(=O)c2c1c1ccccc1n2C

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.78
SMN1; SMN2 Q16637 1/20 0.50
MAPT P10636 2/20 0.49
TP53 P04637 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.48

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
SCHEMBL7497799 0.89 TSPO (0.71) TSPOSMN1; SMN2MAPTTP53KDM4E
SCHEMBL22082635 0.89 TSPO (0.80) TSPOSMN1; SMN2MAPTTP53POLB
SCHEMBL7750505 0.89 TSPO (0.61) TSPOSMN1; SMN2MAPTTP53KDM4E
SCHEMBL197375 0.88 TSPO (1.00) TSPOMAPT
SCHEMBL7501779 0.82 TSPO (0.55) TSPOSMN1; SMN2MAPTTP53KDM4E
SCHEMBL17959423 0.79 TSPO (0.83) TSPOPOLB
SCHEMBL4842381 0.79 TSPO (0.83) TSPO
SCHEMBL5744887 0.79 TSPO (0.66) TSPOSMN1; SMN2POLB
SCHEMBL5745978 0.79 TSPO (0.84) TSPOMAPT
SCHEMBL5746627 0.79 TSPO (0.66) TSPOSMN1; SMN2TP53POLB

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
US-20170160287-A1 USE OF 7-CHLORO-N,N,5-TRIMETHYL-4-OXO-3-PHENYL-3,5-DIHYDRO-4H-PYRIDAZINO[4,5-B] INDOLE-1-ACETAMIDE AS A BIOMARKER OF PERIPHERAL BENZODIAZEPINE RECEPTOR LEVELS SANOFI (FR) 2017-06-08 US disclosed
EP-2349352-B1 Use of 7-chloro-N,N,5-trimethyl-4-oxo-3-phenyl-3,5-dihydro-4H-pyridazino[4,5-b]indole-1-acetamide as a biomarker of peripheral benzodiazepine receptor levels SANOFI SA (FR) 2013-12-25 EP disclosed
US-20120039816-A1 USE OF 7-CHLORO-N,N,5-TRIMETHYL-4-OXO-3-PHENYL-3,5-DIHYDRO-4H-PYRIDAZINO[4,5-B] INDOLE-1-ACETAMIDE AS A BIOMARKER OF PERIPHERAL BENZODIAZEPINE RECEPTOR LEVELS SANOFI-AVENTIS (FR) 2012-02-16 US disclosed
EP-2181717-A1 Use of 7-chloro-N,N,5-trimethyl-4-oxo-3-phenyl-3,5-dihydro-4H-pyridazino[4,5-B]indole-1-acetamide as a biomarker of peripheral benzodiazepine receptor levels Sanofi-Aventis (FR) 2010-05-05 EP disclosed
EP-1000063-B1 4-OXO-3,5-DIHYDRO-4H-PYRIDAZINO[4,5-b]INDOLE-1-ACETAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI SYNTHELABO (FR) 2002-10-23 EP disclosed
US-6262045-B1 TREATMENT OF ANXIETY; SLEEP DISORDER; EPILEPSY; SPASTICITY; MUSCLE CONTRACTURE OR AN EXTRAPYRAMIDAL SYNDROM; INDUCING OR MAINTAINING ANAESTHESIA SANOFI-SYNTHELABO (FR) 2001-07-17 US disclosed