SCHEMBL7743200

SCHEMBL7743200

C#CCO/N=C(C(/C)=N/OCc1ccccc1/C(=C/OC)C(=O)OC)\c1ccc(OCc2ccc(F)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.39
HIF1A Q16665 5/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PLA2G1B P04054 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
NR4A2 P43354 1/20 0.35
LMNA P02545 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
PARP10 Q53GL7 1/20 0.35

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
SCHEMBL7743204 1.00 MAOB (0.39) MAOBHIF1AMEN1KMT2APLA2G1B
SCHEMBL6839059 0.93 PTGS2 (0.34) HIF1AKMT2APLA2G1BATG4B
SCHEMBL7467513 0.91 MAOB (0.41) MAOBHIF1AMEN1KMT2APLA2G1B
SCHEMBL7467515 0.91 MAOB (0.41) MAOBHIF1AMEN1KMT2APLA2G1B
SCHEMBL7736847 0.87 MAOB (0.45) MAOBHIF1ANR4A2
SCHEMBL6841529 0.87 MAOB (0.45) MAOBHIF1ANR4A2
SCHEMBL6841787 0.86 PTGS2 (0.38) HIF1A
SCHEMBL8711326 0.86 PTGS2 (0.38) HIF1A
SCHEMBL8541846 0.84 MAOB (0.38) MAOBMEN1KMT2APLA2G1BATG4B
SCHEMBL7470221 0.84 HIF1A (0.49) MAOBHIF1ANR4A2

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
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