SCHEMBL6436010

SCHEMBL6436010

O=CCc1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 14/20 0.69
MAOA P21397 3/20 0.62
NR4A2 P43354 2/20 0.62
PARP10 Q53GL7 1/20 0.61
SCN9A Q15858 1/20 0.56
GSK3B P49841 1/20 0.54
BACE1 P56817 1/20 0.54

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
SCHEMBL1347334 0.84 MAOB (0.76) MAOBMAOANR4A2PARP10GSK3B
SCHEMBL29464145 0.84 MAOB (0.76) MAOBMAOANR4A2PARP10GSK3B
SCHEMBL27521276 0.83 MAOB (0.77) MAOBMAOANR4A2PARP10
SCHEMBL992837 0.82 MAOB (1.00) MAOBNR4A2PARP10
SCHEMBL28115363 0.81 PTPN1 (0.49) MAOBMAOA
SCHEMBL28115794 0.81 MAOB (0.69) MAOBMAOANR4A2
SCHEMBL28488896 0.81 MAOB (0.73) MAOBMAOANR4A2PARP10SCN9A
SCHEMBL29817726 0.81 MAOB (0.73) MAOBMAOANR4A2PARP10SCN9A
Hydrochloric Acid SCHEMBL21313331 0.81 MAOB (1.00) MAOBNR4A2PARP10
SCHEMBL4228330 0.81 MAOB (0.73) MAOBMAOANR4A2PARP10SCN9A

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-1523469-A1 CINNAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-04-20 EP disclosed
WO-2004007429-A1 CINNAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-01-22 WO disclosed