SCHEMBL7496967

SCHEMBL7496967

Cn1c2ccc(Cl)cc2c2c(CBr)nn(-c3ccccc3)c(=O)c21

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.60
PLK4 O00444 1/20 0.44
MAPK8 P45983 1/20 0.44
MAPK9 P45984 1/20 0.44
AURKB Q96GD4 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
GABRA1 P14867 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42

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
SCHEMBL7493872 0.89 TSPO (0.63) TSPOPLK4MAPK8MAPK9AURKB
SCHEMBL7750398 0.87 TSPO (0.69) TSPOPLK4MAPK8MAPK9AURKB
SCHEMBL7497324 0.86 TSPO (0.57) TSPOPLK4MAPK8MAPK9AURKB
SCHEMBL7493004 0.81 TSPO (0.61) TSPO
SCHEMBL7498096 0.81 TSPO (0.56) TSPOPLK4MAPK8MAPK9AURKB
SCHEMBL5702522 0.80 TSPO (0.74) TSPO
SCHEMBL7499582 0.79 TSPO (0.51) TSPO
SCHEMBL5702540 0.78 TSPO (0.81) TSPO
SCHEMBL7750489 0.78 TP53 (0.53) TSPO
SCHEMBL5702800 0.78 TSPO (0.68) TSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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