SCHEMBL7498166

SCHEMBL7498166

CON=C(C=NOC(C)c1ccccc1C(=NOC)C(=O)OC)c1ccc(Oc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.42
MAPK14 Q16539 1/20 0.37
GCGR P47871 1/20 0.36
RXFP1 Q9HBX9 2/20 0.35
CHEK2 O96017 1/20 0.34
MAPT P10636 1/20 0.34
MAOB P27338 1/20 0.34
PTGER4 P35408 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP13 P45452 1/20 0.33
MMP14 P50281 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
SCHEMBL7494042 0.92 MAPK14 (0.36) HIF1AMAPK14GCGRRXFP1CHEK2
SCHEMBL8721319 0.89 HIF1A (0.40) HIF1ARXFP1MMP13
SCHEMBL8544638 0.87 MAPK14 (0.35) HIF1AMAPK14GCGRRXFP1PTGER4
SCHEMBL8441800 0.83 MAPK14 (0.37) HIF1AMAPK14GCGRRXFP1CHEK2
SCHEMBL7500258 0.81 HIF1A (0.46) HIF1AMAPTMAOBMMP13
SCHEMBL7130516 0.80 HIF1A (0.42) HIF1ARXFP1MAPTMAOB
SCHEMBL7500395 0.79 HIF1A (0.39) HIF1AMAPT
SCHEMBL7492711 0.79 MAPK14 (0.34) HIF1AMAPK14MAOB
SCHEMBL8443188 0.78 PTGER4 (0.33) HIF1ACHEK2PTGER4
SCHEMBL7494944 0.78 HIF1A (0.34) HIF1AMAPT

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 5 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
US-5985921-A OXIDATION AND HYDROGENATION OF COMPOUNDS TO FORM INSECTICIDES AS AGROCHEMICALS NOVARTIS CORPORATION (US) 1999-11-16 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