SCHEMBL7467258

SCHEMBL7467258

CCON=C(C(C)=NOCc1ccccc1C(=COC)C(=O)OC)c1ccc(Oc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.41
MAPK14 Q16539 2/20 0.39
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN11 Q06124 1/20 0.36
GCGR P47871 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL7467255 1.00 HIF1A (0.41) HIF1AMAPK14PTPN2PTPN1PTPN11
SCHEMBL7470560 0.93 HIF1A (0.38) HIF1AMAPK14PTPN1RXFP1
SCHEMBL7470567 0.93 HIF1A (0.38) HIF1AMAPK14PTPN1RXFP1
SCHEMBL8180159 0.92 HIF1A (0.40) HIF1AMAPK14PTPN2PTPN1PTPN11
SCHEMBL8180157 0.92 HIF1A (0.40) HIF1AMAPK14PTPN2PTPN1PTPN11
SCHEMBL7465783 0.90 MAOB (0.47) HIF1A
SCHEMBL7465781 0.90 MAOB (0.47) HIF1A
SCHEMBL7462687 0.90 MAOB (0.47) HIF1A
SCHEMBL7741768 0.88 HIF1A (0.34) HIF1A
SCHEMBL7469944 0.87 ALDH1A1 (0.35) HIF1A

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
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
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