SCHEMBL5269906

SCHEMBL5269906

CCCCOC(=O)NCc1c(-c2ccc(C)cc2)nc2ccc(Cl)nn12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.37
TSPO P30536 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
ALB P02768 1/20 0.37
CYP3A4 P08684 1/20 0.37
CHRM1 P11229 1/20 0.37
GABRA1 P14867 1/20 0.37
HPGD P15428 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA3 P34903 1/20 0.37
ADRA1A P35348 1/20 0.37
OPRK1 P41145 1/20 0.37
HTR2B P41595 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37

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
SCHEMBL5273077 0.92 ALDH1A1 (0.42) ALDH1A1MAPK1TSPOKDM4ELMNA
SCHEMBL5268584 0.87 GABRA1 (0.41) ALDH1A1MAPK1TSPOKDM4ELMNA
SCHEMBL5268891 0.87 KDM4E (0.41) ALDH1A1TSPOKDM4ELMNAALB
SCHEMBL5272481 0.86 LMNA (0.37) ALDH1A1MAPK1KDM4ELMNAALB
SCHEMBL5275273 0.86 GABRA1 (0.37) ALDH1A1MAPK1KDM4ELMNAALB
SCHEMBL5267778 0.85 GABRA1 (0.36) ALDH1A1MAPK1KDM4ELMNAALB
SCHEMBL5272397 0.84 SMN1; SMN2 (0.42) SLC2A2
SCHEMBL5269079 0.84 KDM4E (0.38) ALDH1A1POLBMAPK1KDM4EHPGD
SCHEMBL5270748 0.83 NTRK1 (0.41) ALDH1A1MAPK1TSPOKDM4ELMNA
SCHEMBL5270250 0.83 TSPO (0.42) ALDH1A1TSPOKDM4ELMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1845098-A1 Imidazo[1,2-b]pyridazines, their processes of preparation and their use as GABA receptor ligands FERRER INTERNACIONAL, S.A. (ES) 2007-10-17 EP claimed
WO-2007110438-A1 IMIDAZO [1,2 -B] PYRIDAZINES, THEIR PROCESSES OF PREPARATION AND THEIR USE AS GABA RECEPTOR LIGANDS FERRER INTERNACIONAL, S.A. (ES) 2007-10-04 WO claimed
EP-1845098-A1 Imidazo[1,2-b]pyridazines, their processes of preparation and their use as GABA receptor ligands FERRER INTERNACIONAL, S.A. (ES) 2007-10-17 EP disclosed
WO-2007110438-A1 IMIDAZO [1,2 -B] PYRIDAZINES, THEIR PROCESSES OF PREPARATION AND THEIR USE AS GABA RECEPTOR LIGANDS FERRER INTERNACIONAL, S.A. (ES) 2007-10-04 WO disclosed