SCHEMBL14883115

SCHEMBL14883115

C=CCOc1nc(OC)nc(OC)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
MAPK1 P28482 1/20 0.47
GAA P10253 1/20 0.42
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
HSD17B10 Q99714 1/20 0.34
TP53 P04637 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP1A2 P05177 1/20 0.33
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 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
SCHEMBL4115128 1.00 MAPT (0.47) MAPTMAPK1GAAALDH1A1L3MBTL1
SCHEMBL24157339 0.90 MAPT (0.41) MAPTMAPK1GAAALDH1A1L3MBTL1
SCHEMBL14410167 0.90 MAPT (0.41) MAPTMAPK1GAAALDH1A1L3MBTL1
SCHEMBL23181 0.88 MAPK1 (0.55) MAPTMAPK1ALDH1A1HSD17B10HPGD
SCHEMBL20428258 0.87 MAPT (0.39) MAPTMAPK1GAAALDH1A1L3MBTL1
Hydrogen Sulfide SCHEMBL20395887 0.85 MAPK1 (0.53) MAPTMAPK1ALDH1A1HSD17B10HPGD
SCHEMBL20951779 0.83 MAPT (0.44) MAPTMAPK1ALDH1A1TP53HPGD
SCHEMBL11803039 0.82 MAPK1 (0.47) MAPTMAPK1GAAALDH1A1L3MBTL1
SCHEMBL4111687 0.82 MAPK1 (0.47) MAPTMAPK1GAAALDH1A1L3MBTL1
SCHEMBL14700343 0.82 MAPT (0.47) MAPTMAPK1GAAALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11713361-B2 Hydrogenation catalyst compositions and their use for hydrogenation of nitrile rubber ARLANXEO DEUTSCHLAND GMBH (DE) 2023-08-01 US disclosed
US-11713361-B2 Hydrogenation catalyst compositions and their use for hydrogenation of nitrile rubber ARLANXEO DEUTSCHLAND GMBH (DE) 2023-08-01 US disclosed
US-20210198385-A1 HYDROGENATION CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2021-07-01 US disclosed
US-10508156-B2 Catalyst compositions and their use for hydrogenation of nitrile rubber ARLANXEO DEUTSCHLAND GMBH (DE) 2019-12-17 US disclosed
WO-2019201730-A1 HYDROGENATION CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2019-10-24 WO disclosed
US-20180223005-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2018-08-09 US disclosed
US-20180223005-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2018-08-09 US disclosed
US-20150126683-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2015-05-07 US disclosed
US-20150126683-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2015-05-07 US disclosed
US-20150025199-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2015-01-22 US disclosed
US-20150025199-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2015-01-22 US disclosed
WO-2013057295-A2 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2013-04-25 WO disclosed
WO-2013057289-A2 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2013-04-25 WO disclosed
WO-2013056400-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2013-04-25 WO disclosed
WO-2013056461-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2013-04-25 WO disclosed