SCHEMBL7467262

SCHEMBL7467262

CCON=C(C(C)=C(ON)c1ccccc1C(=COC)C(=O)OC)c1ccc(Oc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.39
GCGR P47871 1/20 0.35
CHEK2 O96017 1/20 0.34
HIF1A Q16665 1/20 0.34
BTK Q06187 1/20 0.34
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
MAPT P10636 2/20 0.33
PTPN2 P17706 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPN11 Q06124 1/20 0.32
KMT2A Q03164 1/20 0.32
EGFR P00533 1/20 0.32
ERBB2 P04626 1/20 0.32
FAAH O00519 1/20 0.32

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
SCHEMBL8180161 0.94 MAPK14 (0.39) MAPK14GCGRCHEK2HIF1ABTK
SCHEMBL7470568 0.93 MAPK14 (0.38) MAPK14HIF1AKMT2A
SCHEMBL7465788 0.89 MAOB (0.47) HIF1AMAPT
SCHEMBL7742091 0.89 MAOB (0.47) HIF1AMAPT
SCHEMBL7469946 0.87 ALDH1A1 (0.35) CHEK2
SCHEMBL7463037 0.87 SMN1; SMN2 (0.38) MAPK14HIF1AMAPTKMT2A
SCHEMBL7469591 0.86 RAB9A (0.31) MAPT
SCHEMBL7465135 0.85 MAOB (0.43) HIF1AMAPT
SCHEMBL8544631 0.84 MAPK14 (0.37) MAPK14GCGRCHEK2HIF1ABTK
SCHEMBL7467255 0.84 HIF1A (0.41) MAPK14GCGRHIF1ARXFP1PTPN2

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