SCHEMBL7497239

SCHEMBL7497239

CNC(=O)C(=NOC)c1ccccc1C(C)ON=CC(=NOC)c1ccc(OC2CCCC2)cc1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
ALDH1A1 P00352 4/20 0.32
HTT P42858 2/20 0.32
PARP10 Q53GL7 1/20 0.32
KMT2A Q03164 2/20 0.32
PDE5A O76074 2/20 0.32
MEN1 O00255 1/20 0.32
ACACB O00763 2/20 0.32
CTSL P07711 2/20 0.32
CTSS P25774 2/20 0.32
CTSK P43235 2/20 0.32
MAPT P10636 2/20 0.31
LMNA P02545 1/20 0.31
HRH3 Q9Y5N1 2/20 0.31
KCNA5 P22460 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL8540313 0.94 KMT2A (0.34) PTGS1PTGS2ALDH1A1HTTKMT2A
SCHEMBL7494944 0.92 HIF1A (0.34) PTGS1PTGS2ALDH1A1HTTPARP10
SCHEMBL7503280 0.84 MAPT (0.35) ALDH1A1HTTCTSLCTSSMAPT
SCHEMBL7495599 0.83 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1MAPTLMNA
SCHEMBL7505113 0.83 PLK1 (0.39) ALDH1A1HTTKMT2AMEN1MAPT
SCHEMBL7495786 0.79 HIF1A (0.33)
SCHEMBL7494042 0.79 MAPK14 (0.36) MAPT
SCHEMBL7498643 0.78 ALDH1A1 (0.34) ALDH1A1HTTKMT2AMEN1MAPT
SCHEMBL7501826 0.77 HIF1A (0.34) ALDH1A1HTTMAPTLMNA
SCHEMBL7498531 0.76 HTR2A (0.33) KCNH2

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 3 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