SCHEMBL27619660

SCHEMBL27619660

FNc1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 14/20 0.67
▸ NR4A2 P43354 2/20 0.60
▸ PARP10 Q53GL7 1/20 0.58
▸ PPARA Q07869 1/20 0.53
▸ MAOA P21397 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ PLA2G1B P04054 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ ATG4B Q9Y4P1 1/20 0.52

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
SCHEMBL4343925 0.86 MAOB (0.65) MAOBNR4A2PARP10MAOAKDM4E
SCHEMBL157732 0.86 MAOB (0.65) MAOBNR4A2PARP10PPARAMAOA
SCHEMBL27521276 0.84 MAOB (0.77) MAOBNR4A2PARP10MAOA
SCHEMBL22874578 0.82 MAOB (0.60) MAOBNR4A2PARP10MAOAKDM4E
SCHEMBL22874577 0.82 MAOB (0.60) MAOBNR4A2PARP10MAOAKDM4E
SCHEMBL3625818 0.81 MAOB (0.73) MAOBNR4A2PARP10MAOALMNA
SCHEMBL15171108 0.81 MAOB (0.73) MAOBNR4A2PARP10MAOA
SCHEMBL11959694 0.81 MAOB (0.72) MAOBNR4A2PARP10MAOA
SCHEMBL21340832 0.80 MAOB (0.79) MAOBNR4A2PARP10MAOA
SCHEMBL22874674 0.80 MAOB (0.71) MAOBNR4A2PARP10MAOAKDM4E

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
CN-100503562-C Pyrrolidone derivatives as MAOB inhibitors HOFFMANN LA ROCHE (CH) 2009-06-24 — — CN disclosed
CN-100482638-C N-acylaminobenzene dervatives as selective monoamine oxidase b inhibitors HOFFMANN LA ROCHE (CH) 2009-04-29 — — CN disclosed
CN-1681777-A Pyrrolidone derivatives as MAOB inhibitors HOFFMANN LA ROCHE (CH) 2005-10-12 — — CN disclosed
CN-1656057-A N-acylaminobenzene dervatives as selective monoamine oxidase b inhibitors HOFFMANN LA ROCHE (CH) 2005-08-17 — — CN disclosed
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