SCHEMBL7721134

SCHEMBL7721134

COC(=O)Cc1nn(-c2ccccc2)c(=O)c2c1c1ccc(Cl)cc1n2C

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.76
TP53 P04637 3/20 0.46
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL5702540 0.90 TSPO (0.81) TSPOTP53MAPT
SCHEMBL8959235 0.89 TSPO (0.71) TSPOTP53MAPTPOLB
SCHEMBL5702522 0.88 TSPO (0.74) TSPOTP53MAPT
SCHEMBL197375 0.86 TSPO (1.00) TSPOMAPT
SCHEMBL7496839 0.85 TSPO (0.82) TSPOTP53MAPTPOLB
SCHEMBL6256479 0.83 TSPO (0.71) TSPOMAPTPOLB
SCHEMBL8959261 0.83 TSPO (0.83) TSPOMAPT
SCHEMBL7750398 0.82 TSPO (0.69) TSPO
SCHEMBL14300517 0.82 TSPO (0.80) TSPOMAPT
SCHEMBL5702800 0.81 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
US-6395729-B1 CENTRAL NERVOUS SYSTEM DISORDERS SANOFI-SYNTHELABO (FR) 2002-05-28 US 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