SCHEMBL4621119

SCHEMBL4621119

[CH2]OC(OC(=O)CCC)C(O)CO

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 5/20 0.39
ALDH1A1 P00352 3/20 0.39
PRKCA P17252 6/20 0.35
PRKCE Q02156 2/20 0.35
PRKCQ Q04759 2/20 0.35
PRKCD Q05655 2/20 0.35
KDM4E B2RXH2 1/20 0.33
DUSP3 P51452 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FAAH O00519 1/20 0.33
HPGD P15428 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 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
SCHEMBL4623515 0.85 MEN1 (0.32) MAPTMAPK1MEN1KMT2A
SCHEMBL4620758 0.83 MAPT (0.38) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL6203333 0.82 MAPT (0.40) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL6203438 0.82 MAPT (0.40) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL5606421 0.82 MAPT (0.40) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL6203825 0.81 MAPT (0.39) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL6203104 0.81 MAPT (0.39) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL4621253 0.79 MAPT (0.38) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL6650030 0.77 TSHR (0.36) MAPTPRKCA
SCHEMBL5847228 0.76 ALDH1A1 (0.43) MAPTMAPK1LMNAALDH1A1PRKCA

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1883622-A1 SUBSTITUTED ARYL OXIMES Bayer CropScience Aktiengesellschaft (DE) 2008-02-06 EP claimed
EP-1831145-A1 SUBSTITUTED OXYARENES Bayer CropScience Aktiengesellschaft (DE) 2007-09-12 EP claimed
WO-2007090434-A1 SUBSTITUTED ARYL OXIMES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-08-16 WO claimed
WO-2006069685-A1 SUBSTITUTED OXYARENES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2006-07-06 WO claimed
EP-1883622-A1 SUBSTITUTED ARYL OXIMES Bayer CropScience Aktiengesellschaft (DE) 2008-02-06 EP disclosed
EP-1831145-A1 SUBSTITUTED OXYARENES Bayer CropScience Aktiengesellschaft (DE) 2007-09-12 EP disclosed
WO-2007090434-A1 SUBSTITUTED ARYL OXIMES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-08-16 WO disclosed
WO-2006069685-A1 SUBSTITUTED OXYARENES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2006-07-06 WO disclosed
WO-2006037496-A1 POLYHALOGENATED PROPENE BENZOQUINONE DIOXIME DERIVATIVES AND ITS USE AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2006-04-13 WO disclosed
EP-0120238-B1 MICROBIOCIDAL AGENT FOR THE PROTECTION OF TECHNICAL MATERIALS BAYER AG (DE) 1986-10-15 EP disclosed
EP-0116889-B1 CYCLOPROPYLMETHYL(ENE) ETHERS, PROCESS FOR PREPARING THEM AND THEIR USE IN PESTICIDAL COMPOSITIONS BAYER AG (DE) 1986-04-23 EP disclosed
US-4575517-A Microbicidal agent for preserving industrial materials BAYER AKTIENGESELLSCHAFT (DE) 1986-03-11 US disclosed
US-4575516-A SYNERGISTS BAYER AKTIENGESELLSCHAFT (DE) 1986-03-11 US disclosed
EP-0120238-A1 Microbiocidal agent for the protection of technical materials BAYER AG (DE) 1984-10-03 EP disclosed