SCHEMBL60462

SCHEMBL60462

O=CCCC(O)OP(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.44
PGK1 P00558 1/20 0.38
PGK2 P07205 1/20 0.38
PGD P52209 3/20 0.35
SMPD1 P17405 3/20 0.34
S1PR4 O95977 2/20 0.31
S1PR1 P21453 2/20 0.31
S1PR3 Q99500 2/20 0.31
S1PR5 Q9H228 2/20 0.31
S1PR2 O95136 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSPO P30536 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
PTPN1 P18031 1/20 0.31
LPAR2 Q9HBW0 1/20 0.31
LPAR3 Q9UBY5 1/20 0.31

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
SCHEMBL4434843 0.77 MPI (0.38) MPIPGK1PGK2SMPD1
SCHEMBL6045766 0.75 MPI (0.37) MPIPGK1PGK2SMPD1S1PR1
SCHEMBL27496296 0.75 PGK1 (0.52) MPIPGK1PGK2PGDLPAR2
SCHEMBL7156062 0.75 PTPN1 (0.41) MPIPGK1PGK2PGDSMPD1
SCHEMBL6045527 0.74 MPI (0.53) MPIPGK1PGK2PGDLPAR2
SCHEMBL2676632 0.73 SMPD1 (0.50) SMPD1S1PR4S1PR1S1PR3S1PR2
Phosphoric Acid SCHEMBL6030243 0.71 SMPD1 (0.35) PGK1PGK2SMPD1PTPN1
SCHEMBL8165767 0.71 PTPN1 (0.50) PGK1PGK2SMPD1PTPN1
SCHEMBL11503275 0.70
SCHEMBL60413 0.70 LMNA (0.39) SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11932845-B2 Microorganisms and methods for production of 4-hydroxybutyrate, 1,4-butanediol and related compounds GENOMATICA, INC. (US) 2024-03-19 US disclosed
US-20230065295-A1 MICROORGANISMS AND METHODS FOR PRODUCTION OF 4-HYDROXYBUTYRATE, 1,4-BUTANEDIOL AND RELATED COMPOUNDS GENOMATICA INC (US) 2023-03-02 US disclosed
EP-4056706-A1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL AND RELATED METHODS Genomatica, Inc. (US) 2022-09-14 EP disclosed
US-11401534-B2 Microorganisms for the production of 1,4- butanediol and related methods GENOMATICA, INC. (US) 2022-08-02 US disclosed
EP-3392340-B1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL AND RELATED METHODS GENOMATICA INC (US) 2022-01-05 EP disclosed
US-11085015-B2 Microorganisms and methods for production of 4-hydroxybutyrate, 1,4-butanediol and related compounds GENOMATICA, INC. (US) 2021-08-10 US disclosed
EP-3831951-A2 MICROORGANISMS AND METHODS FOR PRODUCTION OF 4-HYDROXYBUTYRATE, 1,4-BUTANEDIOL AND RELATED COMPOUNDS Genomatica, Inc. (US) 2021-06-09 EP disclosed
EP-2855687-B1 MICROORGANISMS AND METHODS FOR PRODUCTION OF 4-HYDROXYBUTYRATE, 1,4-BUTANEDIOL AND RELATED COMPOUNDS GENOMATICA INC (US) 2020-04-22 EP disclosed
US-20190264240-A1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL, 4-HYDROXYBUTANAL, 4-HYDROXYBUTYRYL-COA, PUTRESCINE AND RELATED COMPOUNDS, AND METHODS RELATED THERETO GENOMATICA INC (US) 2019-08-29 US disclosed
EP-3514242-A2 MICRORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL Genomatica, Inc. (US) 2019-07-24 EP disclosed
US-20110229946-A1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL, 4-HYDROXYBUTANAL, 4-HYDROXYBUTYRYL-COA, PUTRESCINE AND RELATED COMPOUNDS, AND METHODS RELATED THERETO GENOMATICA, INC. (US) 2011-09-22 US disclosed
US-20110159572-A1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL GENOMATICA, INC. (US) 2011-06-30 US disclosed
EP-2334800-A2 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL Genomatica, Inc. (US) 2011-06-22 EP disclosed
US-20110129899-A1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL, 4-HYDROXYBUTANAL, 4-HYDROXYBUTYRYL-COA, PUTRESCINE AND RELATED COMPOUNDS, AND METHODS RELATED THERETO AGAIN BIO APS (DK) 2011-06-02 US disclosed
WO-2011047101-A1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL, 4-HYDROXYBUTANAL, 4-HYDROXYBUTYRYL-COA, PUTRESCINE AND RELATED COMPOUNDS, AND METHODS RELATED THERETO GENOMATICA, INC. (US) 2011-04-21 WO disclosed
US-20110045575-A1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL AND RELATED METHODS GENOMATICA, INC. 2011-02-24 US disclosed
US-7858350-B2 Microorganisms for the production of 1,4-butanediol GENOMATICA, INC. (US) 2010-12-28 US disclosed
WO-2010141920-A2 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL AND RELATED METHODS GENOMATICA, INC. (US) 2010-12-09 WO disclosed
US-20100112654-A1 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL AGAIN BIO APS (DK) 2010-05-06 US disclosed
WO-2010030711-A2 MICROORGANISMS FOR THE PRODUCTION OF 1,4-BUTANEDIOL GENOMATICA, INC. (US) 2010-03-18 WO disclosed