SCHEMBL15057710

SCHEMBL15057710

C=CC(C)(O)CC(=O)O

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
SCHEMBL1821089 0.77
SCHEMBL10717254 0.77
SCHEMBL9652716 0.76 ALOX15 (0.47)
SCHEMBL10879539 0.75 HMGCR (0.52)
SCHEMBL8436127 0.74 ALDH1A1 (0.43)
SCHEMBL16438125 0.73 HMGCR (0.64)
SCHEMBL10974694 0.73 HMGCR (0.64)
SCHEMBL28568122 0.73 PTPN1 (0.46)
SCHEMBL11006268 0.72
SCHEMBL544642 0.72 HMGCR (0.61)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110234761-B Mevalonate diphosphate decarboxylase variant and method for producing olefin compound using same 国立研究开发法人理化学研究所 2024-02-13 CN claimed
CN-109715815-B Mevalonate diphosphate decarboxylase variant and process for producing olefin compound using the same 国立研究开发法人理化学研究所 2022-11-29 CN claimed
EP-3333263-B1 DIPHOSPHOMEVALONATE DECARBOXYLASE VARIANT AND METHOD FOR MANUFACTURING OLEFIN COMPOUND USING SAME RIKEN (JP) 2021-12-29 EP claimed
US-10988751-B2 Diphosphomevalonate decarboxylase variant and method for manufacturing olefin compound using same RIKEN (JP) 2021-04-27 US claimed
US-10961548-B2 Diphosphomevalonate decarboxylase variant and method for producing olefin compound by using the same RIKEN (JP) 2021-03-30 US claimed
US-20180297911-A1 MATERIALS AND METHODS FOR PRODUCING ALKENES AND DERIVATIVES THEREOF INVISTA NORTH AMERICA S.A.R.L. (US) 2018-10-18 US claimed
US-20180134635-A1 METHODS FOR PRODUCING ALKENES AND DERIVATIVES THEREOF INVISTA NORTH AMERICA S.A.R.L. (US) 2018-05-17 US claimed
US-9969658-B2 Materials and methods for producing alkenes and derivatives thereof INVISTA NORTH AMERICA S.A.R.L. (US) 2018-05-15 US claimed
US-20180127788-A1 METHODS FOR BIOSYNTHESIS OF ISOPRENE INVISTA NORTH AMERICA S.A.R.L. (US) 2018-05-10 US claimed
US-9873895-B2 Production of 1,3-dienes by enzymatic conversion of 3-hydroxyalk 4-enoates and/or 3-phosphonoxyalk-4-enoates SCIENTIST OF FORTUNE S.A. (LU) 2018-01-23 US claimed
US-9862973-B2 Methods for biosynthesis of isoprene INVISTA NORTH AMERICA S.A.R.L. (US) 2018-01-09 US claimed
WO-2016164812-A1 METHODS FOR PRODUCING ALKENES AND DERIVATIVES THEREOF INVISTA NORTH AMERICA S.A.R.L. (US) 2016-10-13 WO claimed
EP-3030667-A2 METHODS FOR BIOSYNTHESIS OF ISOPRENE Invista Technologies S.a r.l. (CH) 2016-06-15 EP claimed
WO-2015021045-A2 METHODS FOR BIOSYNTHESIS OF ISOPRENE INVISTA North America S.á r.l. (US) 2015-02-12 WO claimed
US-20150037860-A1 METHODS FOR BIOSYNTHESIS OF ISOPRENE INV NYLON CHEMICALS AMERICAS, LLC 2015-02-05 US claimed
US-20140370565-A1 Production of 1,3-Dienes by Enzymatic Conversion of 3-Hydroxyalk-4-Enoates and/or 3-Phosphonoxyalk-4-Enoates Scientist of Fortune, S.A. (LU) 2014-12-18 US claimed
EP-2794891-A2 PRODUCTION OF 1,3-DIENES BY ENZYMATIC CONVERSION OF 3-HYDROXYALK-4-ENOATES AND/OR 3-PHOSPHONOXYALK-4-ENOATES Scientist of Fortune S.A. (LU) 2014-10-29 EP claimed
WO-2013092567-A2 PRODUCTION OF 1,3-DIENES BY ENZYMATIC CONVERSION OF 3-HYDROXYALK-4-ENOATES AND/OR 3-PHOSPHONOXYALK-4-ENOATES SCIENTIST OF FORTUNE S.A. (LU) 2013-06-27 WO claimed
CN-110234761-B Mevalonate diphosphate decarboxylase variant and method for producing olefin compound using same 国立研究开发法人理化学研究所 2024-02-13 CN disclosed
WO-2013092567-A2 PRODUCTION OF 1,3-DIENES BY ENZYMATIC CONVERSION OF 3-HYDROXYALK-4-ENOATES AND/OR 3-PHOSPHONOXYALK-4-ENOATES SCIENTIST OF FORTUNE S.A. (LU) 2013-06-27 WO disclosed