SCHEMBL7736860

SCHEMBL7736860

CCON=C(C=NOC(C)c1ccccc1C(=COC)C(=O)OC)c1ccc(OCc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.39
FFAR1 O14842 2/20 0.36
PPARG P37231 1/20 0.36
SLC6A5 Q9Y345 4/20 0.36
PPARA Q07869 1/20 0.35
SPHK2 Q9NRA0 1/20 0.35
SPHK1 Q9NYA1 1/20 0.35
ADAMTS4 O75173 1/20 0.35
MMP13 P45452 1/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
MME P08473 1/20 0.35
ACE P12821 1/20 0.35
CPA1 P15085 1/20 0.35
ACE2 Q9BYF1 1/20 0.35
HIF1A Q16665 1/20 0.34
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
PSEN1 P49768 1/20 0.33

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
SCHEMBL7496505 0.92 MAOB (0.43) MAOBFFAR1SPHK2SPHK1ADAMTS4
SCHEMBL7741762 0.92 HDAC1 (0.37) MAOBPPARGADAMTS4MMP13MMP2
SCHEMBL7742973 0.91 NPC1 (0.39) MAOBFFAR1PPARAHIF1A
SCHEMBL7497710 0.86 MAOB (0.41) MAOBFFAR1SPHK2SPHK1ADAMTS4
SCHEMBL7493123 0.86 MAOB (0.41) MAOBSPHK2SPHK1ADAMTS4MMP13
SCHEMBL8441800 0.86 MAPK14 (0.37) HIF1A
SCHEMBL7499092 0.85 MAOB (0.39) MAOBFFAR1PPARGSLC6A5PPARA
SCHEMBL7736851 0.84 MAOB (0.41) MAOBFFAR1SPHK2SPHK1ADAMTS4
SCHEMBL7743206 0.84 HDAC1 (0.35) MAOBFFAR1PPARAADAMTS4MMP13
SCHEMBL7498420 0.83 SMN1; SMN2 (0.36) MAOB

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
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
US-5985921-A OXIDATION AND HYDROGENATION OF COMPOUNDS TO FORM INSECTICIDES AS AGROCHEMICALS NOVARTIS CORPORATION (US) 1999-11-16 US disclosed