SCHEMBL7497220

SCHEMBL7497220

CNC(=O)/C(=N/OC)c1ccccc1/C(ON)=C(C)/C(=N\OC)c1ccc(OC2CCCC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.37
ALDH1A1 P00352 5/20 0.36
MAPT P10636 3/20 0.36
LMNA P02545 3/20 0.35
HTT P42858 2/20 0.35
PDE4B Q07343 1/20 0.34
PDE4D Q08499 1/20 0.34
MAPK14 Q16539 1/20 0.34
PDE5A O76074 2/20 0.34
SRD5A1 P18405 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ACACB O00763 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
SCHEMBL8540309 0.94 ALDH1A1 (0.36) PARP10ALDH1A1MAPTLMNAHTT
SCHEMBL7494934 0.91 PARP10 (0.39) PARP10ALDH1A1MAPTLMNAHTT
SCHEMBL7503269 0.80 MAPT (0.38) ALDH1A1MAPTLMNAHTTNPC1
SCHEMBL7497225 0.78 HIF1A (0.40) PARP10ALDH1A1MAPTLMNAHTT
SCHEMBL7464106 0.78 HIF1A (0.35) ALDH1A1MAPTNPC1SMN1; SMN2MEN1
SCHEMBL7494028 0.76 MAPK14 (0.39) MAPTMAPK14RAB9A
SCHEMBL7466206 0.75 MAPK14 (0.36) LMNAMAPK14MEN1KMT2A
SCHEMBL7470381 0.75 HTR2A (0.34) KMT2A
SCHEMBL8540310 0.75 HIF1A (0.37) ALDH1A1MAPTLMNAHTTPDE5A
SCHEMBL7498630 0.74 CPS1 (0.37) PARP10ALDH1A1MAPTLMNAHTT

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