SCHEMBL7497769

SCHEMBL7497769

Cc1ccc2c(c1)c1c(CO)nn(-c3ccccc3)c(=O)c1n2C

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.51
POLB P06746 2/20 0.46
TSHR P16473 3/20 0.46
KMT2A Q03164 3/20 0.46
HPGD P15428 3/20 0.46
MAPT P10636 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPK1 P28482 1/20 0.46
RXFP1 Q9HBX9 3/20 0.46
TP53 P04637 6/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
HSD17B10 Q99714 2/20 0.45
ALOX15 P16050 1/20 0.44

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
SCHEMBL7750388 0.89 TSPO (0.56) TSPOPOLBTSHRKMT2AHPGD
SCHEMBL7499582 0.89 TSPO (0.51) TSPOPOLBTSHRKMT2AHPGD
SCHEMBL7493872 0.88 TSPO (0.63) TSPOMAPTTP53
SCHEMBL7492444 0.86 TSPO (0.46) TSPOPOLBTSHRKMT2AHPGD
SCHEMBL7497799 0.85 TSPO (0.71) TSPOTSHRKMT2AHPGDMAPT
SCHEMBL5702522 0.81 TSPO (0.74) TSPOMAPTTP53
SCHEMBL7750398 0.77 TSPO (0.69) TSPO
SCHEMBL22082635 0.77 TSPO (0.80) TSPOPOLBMAPTTP53SMN1; SMN2
SCHEMBL7496967 0.76 TSPO (0.60) TSPO
SCHEMBL7750505 0.75 TSPO (0.61) TSPOPOLBTSHRKMT2AHPGD

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