SCHEMBL5268891

SCHEMBL5268891

Cc1ccc(OC(=O)NCc2c(-c3ccc(C)cc3)nc3ccc(Cl)nn23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
NPC1 O15118 2/20 0.41
ALDH1A1 P00352 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
MAPT P10636 2/20 0.41
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
ALB P02768 1/20 0.39
CYP3A4 P08684 1/20 0.39
CHRM1 P11229 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA3 P34903 1/20 0.39
ADRA1A P35348 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL5270250 0.96 TSPO (0.42) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL5268657 0.95 FAAH (0.43) KDM4ENPC1ALDH1A1RAB9AHPGD
SCHEMBL5269452 0.92 MGLL (0.44) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL5268584 0.90 GABRA1 (0.41) KDM4EALDH1A1LMNAHPGDGABRA1
SCHEMBL5273077 0.88 ALDH1A1 (0.42) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL5269906 0.87 ALDH1A1 (0.41) KDM4EALDH1A1LMNAHPGDGABRA1
SCHEMBL5275273 0.85 GABRA1 (0.37) KDM4ENPC1ALDH1A1RAB9ALMNA
SCHEMBL5272481 0.85 LMNA (0.37) KDM4ENPC1ALDH1A1RAB9ALMNA
SCHEMBL5270748 0.84 NTRK1 (0.41) KDM4EALDH1A1LMNAHPGDGABRA1
SCHEMBL5267778 0.84 GABRA1 (0.36) KDM4ENPC1ALDH1A1RAB9ALMNA

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