SCHEMBL7472529

SCHEMBL7472529

CC(=NO)C(=O)c1ccc(OCc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.76
NR4A2 P43354 2/20 0.70
MAPT P10636 2/20 0.61
HTT P42858 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
FFAR1 O14842 1/20 0.59
FFAR4 Q5NUL3 1/20 0.59
MRGPRX4 Q96LA9 2/20 0.56
PDGFRA P16234 1/20 0.54
S1PR1 P21453 1/20 0.54
S1PR5 Q9H228 1/20 0.54
PTPRC P08575 1/20 0.53
PTPN1 P18031 1/20 0.53
POLB P06746 1/20 0.53
MAOA P21397 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
SCHEMBL7472525 1.00 MAOB (0.76) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL7257895 0.89 MAOB (0.81) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL6835124 0.87 MAOB (0.74) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL6835123 0.87 MAOB (0.74) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL20463439 0.86 MAOB (1.00) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL6839169 0.84 MAOB (0.63) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL7795135 0.84 MAOB (0.63) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL6839961 0.84 MAOB (0.63) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL14014028 0.82 NR4A2 (1.00) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL10890134 0.82 MAOB (0.68) MAOBNR4A2HTTL3MBTL1PTPRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1238337-C Pesticide BAYER AG (DE) 2006-01-25 CN disclosed
CN-1491937-A Pesticide �����ɷ� 2004-04-28 CN disclosed
CN-1117071-C Pesticide NOVARTIS AG (CH) 2003-08-06 CN disclosed
EP-0865424-B1 PESTICIDES BAYER AG (DE) 2002-09-18 EP disclosed
US-6420423-B1 PESTICIDE FOR USE ON CEREALS, BEETS, FRUITS, BERRIES, AND BEANS; KILLS MITES, INSECTS, TERMITES, LICE, FLEAS, AND FUNGUS; TOLERATED WELL BE ANIMALS, PLANTS, AND FISH BAYER AKTIENGESELLSCHAFT (DE) 2002-07-16 US disclosed
EP-1207152-A2 Pesticides Bayer Aktiengesellschaft (DE) 2002-05-22 EP disclosed
US-5985921-A OXIDATION AND HYDROGENATION OF COMPOUNDS TO FORM INSECTICIDES AS AGROCHEMICALS NOVARTIS CORPORATION (US) 1999-11-16 US disclosed
CN-1207725-A Pesticide NOVARTIS AG (CH) 1999-02-10 CN disclosed
EP-0865424-A1 PESTICIDES Novartis AG (CH) 1998-09-23 EP disclosed
WO-1997020809-A1 PESTICIDES NOVARTIS AG (CH) 1997-06-12 WO disclosed