SCHEMBL6827176

SCHEMBL6827176

O=c1cc(Br)cc(C2CCOCC2)o1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.39
MAPT P10636 1/20 0.31
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE1C Q14123 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
RECQL P46063 1/20 0.30

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
SCHEMBL6827261 0.89 MAPT (0.38) MAPT
SCHEMBL6829521 0.85 CYP1B1 (0.38) DAOMAPT
SCHEMBL6829397 0.84 CYP1B1 (0.40) DAOMAPT
SCHEMBL6827962 0.79 TDP1 (0.47) DAOMAPTKDM5BRECQL
SCHEMBL6829594 0.77 MAPT (0.34) DAOMAPT
SCHEMBL6824261 0.73 PRKDC (0.41) DAO
SCHEMBL6824851 0.71 CYP1B1 (0.40) MAPT
SCHEMBL24270199 0.69 DAO (0.37) DAOMAPT
SCHEMBL4773892 0.66 DAO (0.35) DAOMAPTKDM5B
SCHEMBL1263377 0.66 TDP1 (0.53) MAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004050624-A1 SUBSTITUTED 1H-PYRIDINE-2-ONE DERIVATIVES C & C RESEARCH LABORATORIES (KR) 2004-06-17 WO disclosed