SCHEMBL4552204

SCHEMBL4552204

[CH2]c1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 14/20 0.71
NR4A2 P43354 2/20 0.63
PARP10 Q53GL7 1/20 0.61
MAOA P21397 2/20 0.55
IDO1 P14902 1/20 0.53
AGXT P21549 1/20 0.53

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
SCHEMBL27521276 0.87 MAOB (0.77) MAOBNR4A2PARP10MAOAIDO1
SCHEMBL3625818 0.84 MAOB (0.73) MAOBNR4A2PARP10MAOA
SCHEMBL15171108 0.84 MAOB (0.73) MAOBNR4A2PARP10MAOAIDO1
SCHEMBL11959694 0.84 MAOB (0.72) MAOBNR4A2PARP10MAOAIDO1
SCHEMBL1379497 0.83 MAOB (1.00) MAOBNR4A2PARP10MAOAIDO1
SCHEMBL992837 0.83 MAOB (1.00) MAOBNR4A2PARP10
SCHEMBL21340832 0.83 MAOB (0.79) MAOBNR4A2PARP10MAOA
SCHEMBL22874674 0.83 MAOB (0.71) MAOBNR4A2PARP10MAOA
SCHEMBL10136590 0.83 MAOB (0.71) MAOBNR4A2PARP10MAOA
SCHEMBL15156306 0.83 MAOB (0.73) MAOBNR4A2PARP10MAOA

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
EP-1761480-B1 MAO-B INHIBITORS HOFFMANN LA ROCHE (CH) 2009-02-18 EP claimed