SCHEMBL6238440

SCHEMBL6238440

CC(=O)Oc1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.74
NR4A2 P43354 2/20 0.68
PARP10 Q53GL7 1/20 0.66
MAOA P21397 2/20 0.65
SCN9A Q15858 1/20 0.57
FFAR1 O14842 1/20 0.56
GRM5 P41594 1/20 0.56

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
SCHEMBL2088282 0.85 MAOB (1.00) MAOBNR4A2PARP10MAOAGRM5
SCHEMBL5044914 0.82 NR4A2 (0.63) MAOBNR4A2PARP10MAOASCN9A
SCHEMBL9626407 0.82 MAOB (0.69) MAOBNR4A2PARP10MAOASCN9A
SCHEMBL3625818 0.81 MAOB (0.73) MAOBNR4A2PARP10MAOA
SCHEMBL1068959 0.81 MAOB (0.70) MAOBNR4A2PARP10FFAR1
SCHEMBL27521276 0.81 MAOB (0.77) MAOBNR4A2PARP10MAOA
SCHEMBL7026306 0.81 MAOB (0.74) MAOBMAOA
SCHEMBL2195021 0.81 NR4A2 (1.00) MAOBNR4A2PARP10
SCHEMBL31591490 0.81 NR4A2 (1.00) MAOBNR4A2PARP10
SCHEMBL2196098 0.80 MAOB (0.75) MAOBNR4A2PARP10MAOASCN9A

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
WO-2005009104-A2 BENZOIC AND PHENYL ACETIC ACID DERIVATIVES AS HNF-4 MODULATORS LIGAND PHARMACUETICALS INCORPORATED (US) 2005-02-03 WO claimed
WO-2005009104-A2 BENZOIC AND PHENYL ACETIC ACID DERIVATIVES AS HNF-4 MODULATORS LIGAND PHARMACUETICALS INCORPORATED (US) 2005-02-03 WO disclosed