SCHEMBL4760779

SCHEMBL4760779

COC(=O)Oc1nc[nH]c1OC(=O)OC

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.33
HPGD P15428 4/20 0.33
HSD17B10 Q99714 2/20 0.33
ALDH1A1 P00352 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 2/20 0.33
ALOX15 P16050 1/20 0.33
JAK2 O60674 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP1A2 P05177 1/20 0.31
GDA Q9Y2T3 1/20 0.31
GABRR1 P24046 1/20 0.31
PDPK1 O15530 1/20 0.31
ALK Q9UM73 1/20 0.30
MKNK1 Q9BUB5 1/20 0.30
QPCT Q16769 1/20 0.30

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
SCHEMBL5243244 0.80 KDM4E (0.44) KDM4EHPGDHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL9542967 0.74 CSNK2A2 (0.34) KDM4ESMN1; SMN2MEN1KMT2AGDA
SCHEMBL387538 0.74 CYP2C19 (0.33) KDM4EHSD17B10GDAGABRR1
SCHEMBL9541784 0.71 MEN1 (0.32) KDM4EMEN1KMT2AGDAPDPK1
SCHEMBL9539346 0.71 MEN1 (0.32) HPGDMEN1KMT2AGDAPDPK1
SCHEMBL11112731 0.69 KDM4E (0.33) KDM4EHPGDHSD17B10ALDH1A1MAPT
SCHEMBL11262568 0.68 KDM4E (0.32) KDM4EHPGDHSD17B10ALDH1A1MAPT
SCHEMBL30798682 0.67 QPCT (0.46) KDM4EALDH1A1MAPTHTTKMT2A
SCHEMBL370253 0.67 KDM4E (0.45) KDM4EHPGDHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL2636627 0.67 KDM4E (0.34) KDM4EHPGDHSD17B10ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641799-B8 IMIDAZO-PYRIDAZINONE DERIVATIVES AND IMIDAZO-PYRIDONE DERIVATIVES, PRODUCTION THEREOF, AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM INT (DE) 2008-10-08 EP disclosed
EP-1641799-B1 IMIDAZO-PYRIDAZINONE DERIVATIVES AND IMIDAZO-PYRIDONE DERIVATIVES, PRODUCTION THEREOF, AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM INT (DE) 2008-03-12 EP disclosed
EP-1753729-A1 NOVEL IMIDAZOLE DERIVATIVES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS INTERMEDIATE PRODUCTS FOR PRODUCING MEDICAMENTS AND PESTICIDES Boehringer Ingelheim International GmbH (DE) 2007-02-21 EP disclosed
EP-1641799-A1 IMIDAZO-PYRIDAZINONE DERIVATIVES AND IMIDAZO-PYRIDONE DERIVATIVES, PRODUCTION THEREOF, AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2006-04-05 EP disclosed
WO-2005110999-A1 NOVEL IMIDAZOLE DERIVATIVES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS INTERMEDIATE PRODUCTS FOR PRODUCING MEDICAMENTS AND PESTICIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-24 WO disclosed
WO-2004111051-A1 IMIDAZO-PYRIDAZINONE DERIVATIVES AND IMIDAZO-PYRIDONE DERIVATIVES, PRODUCTION THEREOF, AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-12-23 WO disclosed