SCHEMBL2593815

SCHEMBL2593815

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

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.46
PGK1 P00558 1/20 0.44
PGK2 P07205 1/20 0.44
GPR84 Q9NQS5 4/20 0.41
PGD P52209 2/20 0.41
GABRR1 P24046 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.36
MVD P53602 1/20 0.36
LPAR1 Q92633 2/20 0.35
LPAR3 Q9UBY5 2/20 0.35
LPAR2 Q9HBW0 1/20 0.35

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
SCHEMBL2585075 0.85 MVD (0.50) SLC22A6GPR84GABRR1MAPTMVD
SCHEMBL27626980 0.79 PGK1 (0.57) SLC22A6PGK1PGK2PGDGABRR1
SCHEMBL12332333 0.78 BHMT (0.39) PGK1PGK2PGDMVDLPAR1
SCHEMBL10535577 0.77 THRB (0.40) PGK1PGK2PGDLMNALPAR1
SCHEMBL9169806 0.77 SLC22A6 (0.52) SLC22A6GPR84GABRR1LMNAMAPT
SCHEMBL6403901 0.76 SLC22A6 (0.57) SLC22A6GPR84GABRR1LMNAMAPT
SCHEMBL532287 0.73 LPAR3 (0.50) LPAR1LPAR3LPAR2
SCHEMBL202466 0.73 LPAR3 (0.43) PGK1PGK2PGDLPAR1LPAR3
SCHEMBL26138089 0.72 SLC22A6 (0.75) SLC22A6GPR84GABRR1LMNAMAPT
SCHEMBL11675767 0.72 LPAR3 (0.41) PGK1PGK2PGDLPAR1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220220511-A1 MICROORGANISMS AND METHODS FOR PRODUCING BUTADIENE AND RELATED COMPOUNDS BY FORMATE ASSIMILATION GENOMATICA INC (US) 2022-07-14 US claimed
US-20230399688-A1 COMPOSITIONS AND MULTIPLEXED SYSTEMS FOR COUPLED CELL-FREE TRANSCRIPTION-TRANSLATION AND PROTEIN SYNTHESIS AND METHODS FOR USING THEM GENOMATICA INC (US) 2023-12-14 US disclosed
US-20220220511-A1 MICROORGANISMS AND METHODS FOR PRODUCING BUTADIENE AND RELATED COMPOUNDS BY FORMATE ASSIMILATION GENOMATICA INC (US) 2022-07-14 US disclosed
US-20220025411-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE GENOMATICA INC (US) 2022-01-27 US disclosed
US-20210238609-A1 MICROORGANISMS AND METHODS FOR PRODUCING BUTADIENE AND RELATED COMPOUNDS BY FORMATE ASSIMILATION GENOMATICA INC (US) 2021-08-05 US disclosed
CN-112877370-A Modified microorganism and method for producing butadiene using the same 布拉斯科南美公司 2021-06-01 CN disclosed
US-20210147881-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE GENOMATICA INC (US) 2021-05-20 US disclosed
US-10941454-B2 Vinylisomerase-dehydratases, alkenol dehydratases, linalool dehydratases and crotyl alcohol dehydratases and methods for making and using them GENOMATICA, INC. (US) 2021-03-09 US disclosed
CN-108026214-B Vinyl isomerase-dehydratase, enol-dehydratase, linalool-dehydratase and/or crotyl alcohol dehydratase, and preparation and use thereof 基因组股份公司 2021-03-02 CN disclosed
US-20200299736-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE GENOMATICA INC (US) 2020-09-24 US disclosed
EP-2670852-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE Genomatica, Inc. (US) 2013-12-11 EP disclosed
US-8580543-B2 Microorganisms and methods for the biosynthesis of butadiene GENOMATICA, INC. (US) 2013-11-12 US disclosed
WO-2013090915-A1 MODIFIED MICROORGANISMS AND METHODS OF MAKING BUTADIENE USING SAME BRASKEM S.A. (BR) 2013-06-20 WO disclosed
EP-2566969-A2 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE Genomatica, Inc. (US) 2013-03-13 EP disclosed
US-20130011891-A1 MICROORGANISMS FOR PRODUCING BUTADIENE AND METHODS RELATED THERETO GENOMATICA, INC. 2013-01-10 US disclosed
WO-2012177710-A1 MICROORGANISMS FOR PRODUCING BUTADIENE AND METHODS RELATED THERETO GENOMATICA, INC. (US) 2012-12-27 WO disclosed
US-20120225466-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE GENOMATICA, INC. (US) 2012-09-06 US disclosed
WO-2012106516-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE GENOMATICA, INC. (US) 2012-08-09 WO disclosed
US-20110300597-A1 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE AGAIN BIO APS (DK) 2011-12-08 US disclosed
WO-2011140171-A2 MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF BUTADIENE GENOMATICA, INC. (US) 2011-11-10 WO disclosed