SCHEMBL6013879

SCHEMBL6013879

c1c[nH]c(OB(Oc2ncc[nH]2)Oc2ncc[nH]2)n1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NISCH Q9Y2I1 2/20 0.32
MTOR P42345 1/20 0.32
ADK P55263 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
ALOX15 P16050 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
SCHEMBL1083218 0.81 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2NISCHMTORADK
SCHEMBL5724514 0.81
SCHEMBL876246 0.76 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2NISCHMTORADK
SCHEMBL5624457 0.76 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2NISCHMTORADK
SCHEMBL8579336 0.72
SCHEMBL187790 0.72
SCHEMBL29683638 0.72
SCHEMBL8579331 0.72
SCHEMBL6368310 0.72
SCHEMBL1145756 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1283729-B1 TC AND RE CARBONYL COMPLEXES PREPARED FROM PERTECHNETATES AND PERRHENATES MALLINCKRODT INC (US) 2006-08-30 EP disclosed
US-20050276755-A1 Formulation of Tc and Re carbonyl complexes using stannous ion as the reductant for pertechnetate and perrhenate MALLINCKRODT, INC. (US) 2005-12-15 US disclosed
US-6926883-B1 Group (VII) transition-metal complexes with multidentate aminopolycarboxylate ligands and a kit for producing them MALLINCKRODT INC (US) 2005-08-09 US disclosed
EP-1192166-B1 GROUP(VII) TRANSITION-METAL COMPLEXES WITH MULTIDENTATE AMINOPOLYCARBOXYLATE LIGANDS AND A KIT FOR PRODUCING THEM MALLINCKRODT INC (US) 2004-09-29 EP disclosed
EP-1283729-A2 TC AND RE CARBONYL COMPLEXES FOR PERTECHNETATE AND PERRHENATE MALLINCKRODT INC. (US) 2003-02-19 EP disclosed
US-20020147316-A1 Formulation of Tc and Re carbonyl complexes using stannous ion as the reductant for pertechnetate and perrhenate MALLINCKRODT INC. 2002-10-10 US disclosed
EP-1192166-A1 GROUP(VII) TRANSITION-METAL COMPLEXES WITH MULTIDENTATE AMINOPOLYCARBOXYLATE LIGANDS AND A KIT FOR PRODUCING THEM MALLINCKRODT INC. (US) 2002-04-03 EP disclosed
US-6359119-B1 REACTING A METAL IN PERMETALLATE FORM IN A MIXTURE WITH CARBON MONOXIDE AND A REDUCING AGENT COMPRISING STANNOUS SALT TO FORM CARBONYL COMPLEX MALLINCKRODT INC. 2002-03-19 US disclosed
US-6344178-B1 PREPARED FROM A PERMANGANATE, PERTECHNATE OR PERRHENATE, CARBON MONOXIDE, WATER OR A HALIDE AND OPTIONALLY A LIGAND; LABELLING OF BIOLOGICALLY ACTIVE SUBSTRATES AND OTHER LIGANDS MALLINCKRODT INC. 2002-02-05 US disclosed
EP-1019095-B1 METHOD FOR THE PREPARATION OF FACIAL METAL TRICARBONYL COMPOUNDS AND THEIR USE IN THE LABELLING OF BIOLOGICALLY ACTIVE SUBSTRATES MALLINCKRODT INC (US) 2002-01-16 EP disclosed
EP-0458398-B1 Bleach activation UNILEVER NV (NL) 1997-03-26 EP disclosed
WO-1996040855-A1 BLEACHING COMPOSITIONS CONTAINING IMINE, PEROXIDE COMPOUND AND A TRANSITION METAL CATALYST UNILEVER N.V. (NL) 1996-12-19 WO disclosed
WO-1996023860-A1 AUTOMATIC DISHWASHING COMPOSITIONS COMPRISING COBALT CHELATED CATALYSTS THE PROCTER & GAMBLE COMPANY (US) 1996-08-08 WO disclosed
WO-1996006154-A1 DETERGENT BLEACH COMPOSITION UNILEVER N.V. (NL) 1996-02-29 WO disclosed
WO-1996006157-A1 DETERGENT BLEACH COMPOSITION UNILEVER N.V. (NL) 1996-02-29 WO disclosed
US-5274147-A Reacting a manganese(III) salt with a ligand and oxidizing the complex with hydrogen peroxide LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1993-12-28 US disclosed
US-5244594-A BLEACH ACTIVATION MULTINUCLEAR MANGANESE-BASED COORDINATION COMPLEXES LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1993-09-14 US disclosed
EP-0544490-A1 Detergent bleach compositions UNILEVER PLC (GB) 1993-06-02 EP disclosed
EP-0522817-A1 Process for preparing manganese complexes UNILEVER PLC (GB) 1993-01-13 EP disclosed
EP-0458398-A2 Bleach activation UNILEVER N.V. (NL) 1991-11-27 EP disclosed