SCHEMBL168546

SCHEMBL168546

CC(O)CCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O

nearest known ligand 0.88

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAA50 Q9GZZ1 2/20 0.86
CHAT P28329 2/20 0.82
EP300 Q09472 4/20 0.81
KAT5 Q92993 2/20 0.81
AURKA O14965 2/20 0.81
KAT2B Q92831 1/20 0.81
CREBBP Q92793 1/20 0.74

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
SCHEMBL31099185 1.00 NAA50 (0.86) NAA50CHATEP300KAT5AURKA
SCHEMBL20815900 1.00 NAA50 (0.86) NAA50CHATEP300KAT5AURKA
SCHEMBL14992960 0.97 NAA50 (0.86) NAA50CHATEP300KAT5AURKA
SCHEMBL23924590 0.97 NAA50 (0.86) NAA50CHATEP300KAT5AURKA
SCHEMBL30221076 0.97 NAA50 (0.86) NAA50CHATEP300KAT5AURKA
SCHEMBL20815901 0.96 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL31099171 0.96 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL20524261 0.95 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL1404073 0.95 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL17276002 0.95 NAA50 (0.87) NAA50CHATEP300KAT5AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113684169-B Poly (3-hydroxybutyrate-4-hydroxybutyrate-5-hydroxyvalerate) trimer and microorganism production strain construction thereof 清华大学 2022-04-08 CN disclosed
CN-113684169-A Poly (3-hydroxybutyrate-4-hydroxybutyrate-5-hydroxyvalerate) trimer and microorganism production strain construction thereof 清华大学 2021-11-23 CN disclosed
CN-107098807-B Fermentation pathways for the production of levulinic acid, levulinic acid esters, valerolactone, and derivatives thereof 阿泽达公司 2020-07-10 CN disclosed
US-20190300913-A1 METHODS FOR BIOSYNTHESIZING 1,3 BUTADIENE INVISTA NORTH AMERICA S.A.R.L. 2019-10-03 US disclosed
US-10294496-B2 Methods for biosynthesizing 1,3 butadiene INVISTA NORTH AMERICA S.A.R.L. (US) 2019-05-21 US disclosed
US-10246727-B2 Fermentation route for the production of levulinic acid, levulinate esters and valerolactone and derivatives thereof ARZEDA CORP. (US) 2019-04-02 US disclosed
US-20170275657-A1 FERMENTATION ROUTE FOR THE PRODUCTION OF LEVULINIC ACID, LEVULINATE ESTERS AND VALEROLACTONE AND DERIVATIVES THEREOF ARZEDA CORP. 2017-09-28 US disclosed
US-9523105-B2 Fermentation route for the production of levulinic acid, levulinate esters and valerolactone and derivatives thereof ARZEDA CORPORATION (US) 2016-12-20 US disclosed
CN-103180279-B Fermentation pathways for the production of levulinic acid, levulinic acid esters, valerolactone, and derivatives thereof ARZEDA CORP. (US) 2016-12-14 CN disclosed
US-20160145649-A1 Ethanol Production in Microorganisms JOULE UNLTD TECHNOLOGIES INC (US) 2016-05-26 US disclosed
US-8048666-B1 Ethanol production in microorganisms JOULE UNLIMITED TECHNOLOGIES, INC. (US) 2011-11-01 US disclosed
US-20110262975-A1 ENGINEERED CO2 FIXING MICROORGANISMS PRODUCING CARBON-BASED PRODUCTS OF INTEREST c/o JOULE UNLIMITED, INC. (US) 2011-10-27 US disclosed
EP-2344652-A1 ETHANOL PRODUCTION BY MICROORGANISMS Joule Unlimited, Inc. (US) 2011-07-20 EP disclosed
US-7981647-B2 Engineered CO2 fixing microorganisms producing carbon-based products of interest JOULE UNLIMITED, INC. (US) 2011-07-19 US disclosed
US-7968321-B1 Ethanol production by microorganisms JOULE UNLIMITED, INC. (US) 2011-06-28 US disclosed
US-20110151531-A1 ETHANOL PRODUCTION BY MICROORGANISMS JOULE UNLIMITED, INC. (US) 2011-06-23 US disclosed
EP-2285948-A1 ENGINEERED CO2 FIXING MICROORGANISMS PRODUCING CARBON-BASED PRODUCTS OF INTEREST Joule Unlimited, Inc. (US) 2011-02-23 EP disclosed
US-20110008861-A1 Engineered CO2 Fixing Microorganisms Producing Carbon-Based Products of Interest JOULE UNLIMITED, INC. (US) 2011-01-13 US disclosed
WO-2010044960-A1 ETHANOL PRODUCTION BY MICROORGANISMS JOULE BIOTECHNOLOGIES, INC. (US) 2010-04-22 WO disclosed
WO-2009111513-A1 ENGINEERED CO2 FIXING MICROORGANISMS PRODUCING CARBON-BASED PRODUCTS OF INTEREST JOULE BIOTECHNOLOGIES, INC. (US) 2009-09-11 WO disclosed