SCHEMBL646453

SCHEMBL646453

O=C(O)/C=C/C(=O)OC(CC(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 9/20 0.50
TSHR P16473 2/20 0.36
TP53 P04637 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
EGLN3 Q9H6Z9 1/20 0.36
PYGL P06737 1/20 0.35
TDP1 Q9NUW8 4/20 0.34
KDM4E B2RXH2 3/20 0.33
MAPT P10636 3/20 0.33
POLB P06746 2/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 2/20 0.33
RECQL P46063 2/20 0.33
HSD17B10 Q99714 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.33
KDM1A O60341 1/20 0.33
USP2 O75604 1/20 0.33
TTR P02766 1/20 0.33
MMP1 P03956 1/20 0.33

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
SCHEMBL3716837 1.00 HCAR2 (0.50) HCAR2TSHRTP53EGLN1EGLN3
Succinic Acid SCHEMBL465927 0.94 HCAR2 (0.46) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL28120698 0.94 HCAR2 (0.40) HCAR2PYGLTDP1KDM4EMAPT
Oxaloacetate SCHEMBL3490722 0.88 HCAR2 (0.41) HCAR2PYGL
SCHEMBL9136836 0.88 HCAR2 (0.41) HCAR2PYGL
SCHEMBL26102844 0.82 MMP1 (0.36) HCAR2PYGLTDP1KDM4EMAPT
SCHEMBL19107081 0.82 HCAR2 (0.44) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL19119832 0.82 HCAR2 (0.44) HCAR2TSHRTP53EGLN1EGLN3
Fumaric Acid SCHEMBL5586404 0.81 TSHR (0.41) HCAR2TSHRTP53EGLN1EGLN3
Maleic Acid SCHEMBL5586403 0.81 TSHR (0.41) HCAR2TSHRTP53EGLN1EGLN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4965357-A CATIONIC TENSIDES, ANTIMETABOLITES MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1990-10-23 US claimed
US-11753323-B2 In-situ remediation of sulfate contamination COMMERCIAL LIABILITY PARTNERS, LLC (US) 2023-09-12 US disclosed
US-20220033290-A1 IN-SITU REMEDIATION OF SULFATE CONTAMINATION COMMERCIAL LIABILITY PARTNERS, LLC 2022-02-03 US disclosed
EP-3130676-A1 MUTANT E. COLI STRAIN WITH INCREASED SUCCINIC ACID PRODUCTION Rice University (US) 2017-02-15 EP disclosed
EP-1781797-B1 MUTANT E. COLI STRAIN WITH INCREASED SUCCINIC ACID PRODUCTION RICE UNIVERSITY (US) 2016-10-19 EP disclosed
WO-2016048828-A1 GENETICALLY MODIFIED MICROBES FOR THE BIOLOGICAL CONVERSION OF CARBONACEOUS MATERIALS TO ISOBUTANOL AND ISOAMYL ALCOHOL CIRIS ENERGY, INC. (US) 2016-03-31 WO disclosed
US-20150240264-A1 METHODS FOR CO-PRODUCTION OF A TERPENE, SUCCINATE AND HYDROGEN BRASKEM SA (BR) 2015-08-27 US disclosed
US-20150211024-A1 METHODS FOR PRODUCTION OF A TERPENE AND A CO-PRODUCT BRASKEM S.A. (BR) 2015-07-30 US disclosed
EP-1838837-B1 RECOMBINANT MICROORGANISMS FOR INCREASED PRODUCTION OF ORGANIC ACIDS MICHIGAN BIOTECH INST (US) 2015-04-15 EP disclosed
US-20140357806-A1 THERMAL-RESPONSIVE POLYMER NETWORKS, COMPOSITIONS, AND METHODS AND APPLICATIONS RELATED THERETO UNIVERSITY OF MASSACHUSETTS MEDICAL SCHOOL (US) 2014-12-04 US disclosed
US-7790416-B2 Mutant E. coli strain with increased succinic acid production RICE UNIVERSITY (US) 2010-09-07 US disclosed
EP-1838837-A4 RECOMBINANT MICROORGANISMS FOR INCREASED PRODUCTION OF ORGANIC ACIDS MICHIGAN BIOTECH INST (US) 2009-01-14 EP disclosed
US-20080305533-A1 Recombinant Microorganisms For Increased Production of Organic Acids ORACLE INTERNATIONAL CORPORATION (US) 2008-12-11 US disclosed
CN-101128577-A Recombinant microorganisms for increased production of organic acids MICHIGAN BIOTECH INST (US) 2008-02-20 CN disclosed
EP-1838837-A2 RECOMBINANT MICROORGANISMS FOR INCREASED PRODUCTION OF ORGANIC ACIDS MICHIGAN BIOTECHNOLOGY INSTITUTE (US) 2007-10-03 EP disclosed
US-20070184539-A1 Mutant E. coli Strain with Increased Succinic Acid Production RICE UNIVERSITY (US) 2007-08-09 US disclosed
US-7223567-B2 Mutant E. coli strain with increased succinic acid production RICE UNIVERSITY (US) 2007-05-29 US disclosed
WO-2006083410-A2 RECOMBINANT MICROORGANISMS FOR INCREASED PRODUCTION OF ORGANIC ACIDS MICHIGAN BIOTECHNOLOGY INSTITUTE (US) 2006-08-10 WO disclosed
US-20060046288-A1 Mutant E. coli strain with increased succinic acid production NATIONAL SCIENCE FOUNDATION 2006-03-02 US disclosed
EP-0931142-B1 METHOD AND IMMOBILIZED BIOCATALYST FOR THE PRODUCTION OF L(-) MALIC ACID BAY ZOLTAN ALKALMAZOTT KUTATAS (HU) 2003-05-07 EP disclosed