SCHEMBL3640667

SCHEMBL3640667

CCOC(=O)C(Oc1cccc2cccnc12)C(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.52
ALDH1A1 P00352 4/20 0.52
TP53 P04637 2/20 0.52
HSD17B10 Q99714 2/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
MAPT P10636 7/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 6/20 0.48
LMNA P02545 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
GAA P10253 2/20 0.48
POLB P06746 6/20 0.48
METAP2 P50579 1/20 0.48
METAP1 P53582 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
NPC1 O15118 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL15820245 0.88 POLB (0.54) KDM4EALDH1A1TP53HSD17B10HPGD
SCHEMBL4426013 0.83 LMNA (0.44) KDM4EALDH1A1TP53HSD17B10HPGD
SCHEMBL3407190 0.80 MTNR1A (0.46) KDM4EALDH1A1
SCHEMBL4425369 0.80 LMNA (0.41) KDM4EALDH1A1TP53HSD17B10HPGD
SCHEMBL167490 0.79 KDM4E (0.59) KDM4EALDH1A1TP53HSD17B10HPGD
SCHEMBL30050527 0.79 KDM4E (0.59) KDM4EALDH1A1TP53HSD17B10HPGD
SCHEMBL15818384 0.79 MAPT (0.60) KDM4EALDH1A1TP53HSD17B10HPGD
SCHEMBL10390030 0.77 TSHR (0.51) KDM4EALDH1A1HSD17B10HPGDMEN1
SCHEMBL10750474 0.77 LMNA (0.63) KDM4EALDH1A1TP53HSD17B10HPGD
SCHEMBL5792452 0.76 POLB (0.59) KDM4EALDH1A1MAPTMEN1KMT2A

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2185563-A1 OXASPIROCYCLIC SPIRO-SUBSTITUTED TETRAMIC AND TETRONIC ACID DERIVATIVES Bayer CropScience AG (DE) 2010-05-19 EP claimed
EP-2155673-A2 3-(2-ALKOXY-PHENYL)-SUBSTITUTED TETRAMATES Bayer CropScience AG (DE) 2010-02-24 EP claimed
EP-2114880-A1 CIS-ALKOXYSPIROCYCLIC BIPHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES Bayer CropScience Aktiengesellschaft (DE) 2009-11-11 EP claimed
EP-2099751-A1 BIPHENYL-SUBSTITUTED SPIROCYCLIC KETOENOLS Bayer CropScience Aktiengesellschaft (DE) 2009-09-16 EP claimed
WO-2009015801-A1 OXASPIROCYCLIC SPIRO-SUBSTITUTED TETRAMIC AND TETRONIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-02-05 WO claimed
EP-2013168-A1 ALKOXYALKYL-SUBSTITUTED CYCLIC KETOENOLS Bayer CropScience AG (DE) 2009-01-14 EP claimed
WO-2008138551-A2 3-(2-ALKOXY-PHENYL)-SUBSTITUTED TETRAMATES BAYER CROPSCIENCE AG (DE) 2008-11-20 WO claimed
EP-1966135-A2 3'-ALKOXY-SPIROCYCLOPENTYL-SUBSTITUTED TETRAMIC AND TETRONIC ACIDS Bayer CropScience AG (DE) 2008-09-10 EP claimed
WO-2008067910-A1 CIS-ALKOXYSPIROCYCLIC BIPHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2008-06-12 WO claimed
WO-2008067911-A1 BIPHENYL-SUBSTITUTED SPIROCYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2008-06-12 WO claimed
EP-1587786-A1 2.4-DIHALOGEN-6-(C sb 2 /sb -C sb 3 /sb -ALKYL)-PHENYL SUBSTITUTED TETRAMIC ACID DERIVATIVES Bayer CropScience Aktiengesellschaft (DE) 2005-10-26 EP claimed
EP-1587367-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED CYCLIC DICARBONYL COMPOUNDS AND SAFENERS Bayer CropScience AG (DE) 2005-10-26 EP claimed
WO-2005044796-A1 2-HALOGEN-6-ALKYL-PHENYL SUBSTITUTED SPIROCYCLIC TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-05-19 WO claimed
WO-2004111042-A1 N-HETEROCYCLYL PHENYL-SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-12-23 WO claimed
WO-2004065366-A1 2.4-DIHALOGEN-6-(C2-C3-ALKYL)-PHENYL SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-08-05 WO claimed
WO-2004064520-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED CYCLIC DICARBONYL COMPOUNDS AND SAFENERS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-08-05 WO claimed
EP-1418811-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED CYCLIC KETO-ENOLS AND SAFENERS Bayer CropScience AG (DE) 2004-05-19 EP claimed
EP-1303189-A1 ARYL SULFONYL AMINO CARBONYL TRIAZOLE BASED SELECTIVE HERBICIDES Bayer CropScience AG (DE) 2003-04-23 EP claimed
WO-2003013249-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED CYCLIC KETO-ENOLS AND SAFENERS BAYER CROPSCIENCE AG (DE) 2003-02-20 WO claimed
WO-2002001957-A1 ARYL SULFONYL AMINO CARBONYL TRIAZOLE BASED SELECTIVE HERBICIDES BAYER CROPSCIENCE AG (DE) 2002-01-10 WO claimed