SCHEMBL7497699

SCHEMBL7497699

C=CCO/N=C(C(/C)=N/OCc1ccccc1/C(=C\OC)C(=O)OC)\c1ccc(OCc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.45
HIF1A Q16665 3/20 0.45
NR4A2 P43354 1/20 0.42
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SPHK2 Q9NRA0 1/20 0.39
SPHK1 Q9NYA1 1/20 0.39
ADCYAP1R1 P41586 1/20 0.38
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37

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
SCHEMBL7497703 1.00 MAOB (0.45) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL7465781 0.94 MAOB (0.47) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL7465783 0.94 MAOB (0.47) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL7462687 0.94 MAOB (0.47) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL6839881 0.92 HIF1A (0.53) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL7493117 0.90 MAOB (0.45) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL7493118 0.90 MAOB (0.45) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL7736847 0.90 MAOB (0.45) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL6841529 0.90 MAOB (0.45) MAOBHIF1ANR4A2MAPTHTT
SCHEMBL7465129 0.86 MAOB (0.43) MAOBHIF1ASPHK2SPHK1FFAR1

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
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
EP-0865424-A1 PESTICIDES Novartis AG (CH) 1998-09-23 EP disclosed
WO-1997020809-A1 PESTICIDES NOVARTIS AG (CH) 1997-06-12 WO disclosed