SCHEMBL6015185

SCHEMBL6015185

Cc1cc(C)c(N2CCN(c3c(C)cc(C)cc3C)C2=P(C2CCCCC2)(C2CCCCC2)C2CCCCC2)c(C)c1.Cl[Ru]Cl

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PSMB5 P28074 1/20 0.31
TAS1R3 Q7RTX0 2/20 0.31
TAS1R1 Q7RTX1 2/20 0.31
TAS1R2 Q8TE23 2/20 0.31
EBP Q15125 1/20 0.30
DHCR7 Q9UBM7 1/20 0.30
HRH3 Q9Y5N1 2/20 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
SCHEMBL23087150 0.93 ALDH1A1 (0.35) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL6015183 0.91 ALDH1A1 (0.34) ALDH1A1POLBMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL17836909 0.85 ALDH1A1 (0.33) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL15135079 0.83 PSMB5 (0.31) ALDH1A1POLBMAPTHTTSMN1; SMN2
SCHEMBL4608209 0.81
SCHEMBL5274130 0.81 PSMB5 (0.30) PSMB5
Hydrochloric Acid SCHEMBL1007240 0.80
SCHEMBL19712595 0.80 MEN1 (0.30)
SCHEMBL15333568 0.80
Hydrochloric Acid SCHEMBL15333566 0.79

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 21 patents — showing the first 20. 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-20210198385-A1 HYDROGENATION CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2021-07-01 US disclosed
EP-3781309-A1 HYDROGENATION CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO Deutschland GmbH (DE) 2021-02-24 EP disclosed
CN-112004598-A Hydrogenation catalyst composition and use thereof for hydrogenating nitrile rubber 阿朗新科德国有限责任公司 2020-11-27 CN 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
EP-2768610-B1 PROCESS FOR HYDROGENATION OF NITRILE RUBBER USING CATALYST COMPOSITIONS COMPRISING A RUTHENIUM OR OSMIUM CARBENE COMPLEX AND A TERMINAL OLEFIN ARLANXEO DEUTSCHLAND GMBH (DE) 2018-12-12 EP disclosed
US-20180297022-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2018-10-18 US disclosed
US-20180223005-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2018-08-09 US disclosed
EP-2768611-B1 PROCESS FOR HYDROGENATION OF NITRILE RUBBER USING CATALYST COMPOSITIONS COMPRISING A GRUBBS-HOVEYDA TYPE COMPLEX AND A TERMINAL OLEFIN ARLANXEO DEUTSCHLAND GMBH (DE) 2018-08-01 EP disclosed
US-9598506-B2 Catalyst compositions and their use for hydrogenation of nitrile rubber ARLANXEO DEUTSCHLAND GMBH (DE) 2017-03-21 US disclosed
EP-2768866-B1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2015-11-25 EP disclosed
US-20150166686-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER ARLANXEO DEUTSCHLAND GMBH (DE) 2015-06-18 US disclosed
US-20150126683-A1 CATALYST COMPOSITIONS AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER LANXESS DEUTSCHLAND GMBH (DE) 2015-05-07 US disclosed
EP-2768611-A2 CATALYST COMPOSITIONS COMPRISING A GRUBBS-HOVEYDA TYPE COMPLEX AND A TERMINAL OLEFIN AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER Lanxess Deutschland GmbH (DE) 2014-08-27 EP disclosed
EP-2768610-A2 CATALYST COMPOSITIONS COMPRISING A RUTHENIUM OR OSMIUM CARBENE COMPLEX AND A TERMINAL OLEFIN AND THEIR USE FOR HYDROGENATION OF NITRILE RUBBER Lanxess Deutschland GmbH (DE) 2014-08-27 EP 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
EP-1655321-B1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME ZEON CORP (JP) 2012-11-21 EP disclosed
EP-1655321-A1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME Zeon Corporation (JP) 2006-05-10 EP disclosed