SCHEMBL13735969

SCHEMBL13735969

O=[C]C[Fe]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL20637 0.62
SCHEMBL1388025 0.62
SCHEMBL9713214 0.59
SCHEMBL4508 0.59
SCHEMBL3780816 0.59
SCHEMBL11434239 0.59
SCHEMBL128408 0.59
SCHEMBL21198838 0.59
SCHEMBL1481 0.59
SCHEMBL205855 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3107993-A2 RECOMBINANT MICROORGANISMS FOR THE ENHANCED PRODUCTION OF MEVALONATE, ISOPRENE, ISOPRENOID PRECURSORS, ISOPRENOIDS, AND ACETYL-COA-DERIVED PRODUCTS Danisco US Inc. (US) 2016-12-28 EP disclosed
EP-2984105-A2 PHOSPHOKETOLASES FOE IMPROVED PRODUCTION OF ACETYL COENZYME A-DERIVED METABOLITES, ISOPRENE, ISOPRENOID PRECURSORS, AND ISOPRENOIDS Danisco US Inc. (US) 2016-02-17 EP disclosed
EP-2935364-A2 PRODUCTION OF ISOPRENE, ISOPRENOID, AND ISOPRENOID PRECURSORS USING AN ALTERNATIVE LOWER MEVALONATE PATHWAY Danisco US Inc. (US) 2015-10-28 EP disclosed
WO-2015127305-A2 RECOMBINANT MICROORGANISMS FOR THE ENHANCED PRODUCTION OF MEVALONATE, ISOPRENE, ISOPRENOID PRECURSORS, ISOPRENOIDS, AND ACETYL-COA-DERIVED PRODUCTS DANISCO US INC. (US) 2015-08-27 WO disclosed
EP-2794863-A1 ENHANCED PRODUCTION OF ISOPRENE USING HOST CELLS HAVING DECREASED ISPA ACTIVITY Danisco US Inc. (US) 2014-10-29 EP disclosed
EP-2794876-A1 PRODUCTION OF ISOPRENE UNDER REDUCED OXYGEN INLET LEVELS Danisco US Inc. (US) 2014-10-29 EP disclosed
WO-2014169144-A2 PHOSPHOKETOLASES FOE IMPROVED PRODUCTION OF ACETYL COENZYME A-DERIVED METABOLITES, ISOPRENE, ISOPRENOID PRECUROSORS, AND ISOPRENOIDS DANISCO US INC. (US) 2014-10-16 WO disclosed
WO-2014100726-A2 PRODUCTION OF ISOPRENE, ISOPRENOID, AND ISOPRENOID PRECURSORS USING AN ALTERNATIVE LOWER MEVALONATE PATHWAY DANISCO US INC. (US) 2014-06-26 WO disclosed
EP-2739658-A1 PRODUCTION OF ISOPRENE, ISOPRENOID PRECURSORS, AND ISOPRENOIDS USING ACETOACETYL-COA SYNTHASE Danisco US Inc. (US) 2014-06-11 EP disclosed
EP-2702140-A2 RECOMBINANT MICROORGANISMS FOR ENHANCED PRODUCTION OF MEVALONATE, ISOPRENE, AND ISOPRENOIDS Danisco US Inc. (US) 2014-03-05 EP disclosed
EP-2702139-A1 PRODUCTION OF MEVALONATE, ISOPRENE, AND ISOPRENOIDS USING GENES ENCODING POLYPEPTIDES HAVING THIOLASE, HMG-COA SYNTHASE AND HMG-COA REDUCTASE ENZYMATIC ACTIVITIES Danisco US Inc. (US) 2014-03-05 EP disclosed
WO-2013096917-A1 PRODUCTION OF ISOPRENE UNDER REDUCED OXYGEN INLET LEVELS DANISCO US INC. (US) 2013-06-27 WO disclosed
WO-2013096925-A1 ENHANCED PRODUCTION OF ISOPRENE USING HOST CELLS HAVING DECREASED ISPA ACTIVITY DANISCO US INC. (US) 2013-06-27 WO disclosed
WO-2013020118-A1 PRODUCTION OF ISOPRENE, ISOPRENOID PRECURSORS, AND ISOPRENOIDS USING ACETOACETYL-COA SYNTHASE DANISCO US INC. (US) 2013-02-07 WO disclosed
WO-2012149491-A2 RECOMBINANT MICROORGANISMS FOR ENHANCED PRODUCTION OF MEVALONATE, ISOPRENE, AND ISOPRENOIDS DANISCO US INC. (US) 2012-11-01 WO disclosed
WO-2012149469-A1 PRODUCTION OF MEVALONATE, ISOPRENE, AND ISOPRENOIDS USING GENES ENCODING POLYPEPTIDES HAVING THIOLASE, HMG-COA SYNTHASE AND HMG-COA REDUCTASE ENZYMATIC ACTIVITIES DANISCO US INC. (US) 2012-11-01 WO disclosed