SCHEMBL2705995

SCHEMBL2705995

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

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.35
PGK2 P07205 1/20 0.35
FDPS P14324 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MPI P34949 1/20 0.33
PGD P52209 1/20 0.33
PEPD P12955 1/20 0.30

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
SCHEMBL31461035 0.79 PGK1 (0.34) PGK1PGK2FDPSBLMTDP1
SCHEMBL28070362 0.79 MPI (0.32) MPI
SCHEMBL31461033 0.79 PGK1 (0.34) PGK1PGK2FDPSBLMTDP1
SCHEMBL31461034 0.79 PGK1 (0.34) PGK1PGK2FDPSBLMTDP1
SCHEMBL15229406 0.76 SMPD1 (0.33) PGK1PGK2FDPSBLMTDP1
SCHEMBL15229411 0.76 SMPD1 (0.33) PGK1PGK2FDPSBLMTDP1
SCHEMBL15707798 0.74 PGK1 (0.41) PGK1PGK2FDPSBLMTDP1
SCHEMBL27729476 0.74 PGK1 (0.41) PGK1PGK2FDPSBLMTDP1
SCHEMBL27566711 0.71 SLC1A3 (0.34) PGK1PGK2MPIPGD
SCHEMBL30192538 0.69 PGK1 (0.41) PGK1PGK2FDPSBLMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435552-B1 SOLVENT, SOLUTION, CLEANING COMPOSITION AND METHODS GFBIOCHEMICALS IP ASSETS B V (NL) 2018-10-17 EP disclosed
US-20150291567-A1 TRANSKETALIZED COMPOSITIONS, SYNTHESIS, AND APPLICATIONS GFBIOCHEMICALS LIMITED (MT) 2015-10-15 US disclosed
US-20140135455-A1 TRANSKETALIZED COMPOSITIONS, SYNTHESIS, AND APPLICATIONS SEGETIS, INC. (US) 2014-05-15 US disclosed
US-8653223-B2 Transketalized compositions, synthesis, and applications SEGETIS, INC. (US) 2014-02-18 US disclosed
US-8604077-B2 Ketal compounds from polyols and oxocarboxylates SEGETIS, INC. (US) 2013-12-10 US disclosed
US-8604223-B2 Method of making ketals and acetals SEGETIS, INC. (US) 2013-12-10 US disclosed
US-8569523-B2 2013-10-29 US disclosed
US-8546519-B2 Polyketal compounds, synthesis, and applications SEGETIS, INC. (US) 2013-10-01 US disclosed
US-20120157560-A1 KETAL ESTERS OF ANHYDROPENTITOLS AND USES THEREOF XL TERRA, INC. (US) 2012-06-21 US disclosed
US-20120136070-A1 KETAL ESTERS OF ANHYDROPENTITOLS AND USES THEREOF XL TERRA, INC. (US) 2012-05-31 US disclosed
WO-2010138842-A1 KETAL ESTERS OF ANHYDROPENTITOLS AND USES THEREOF XLTERRA, INC. (US) 2010-12-02 WO disclosed
WO-2010138907-A1 SOLVENT, SOLUTION, CLEANING COMPOSITION AND METHODS SEGETIS INC. (US) 2010-12-02 WO disclosed
US-20100292491-A1 Method of Making Ketals and Acetals SEGETIS, INC. (US) 2010-11-18 US disclosed
EP-2209770-A1 METHOD OF MAKING KETALS AND ACETALS Segetis, Inc. (US) 2010-07-28 EP disclosed
EP-2205606-A2 POLYKETAL COMPOUNDS, SYNTHESIS, AND APPLICATIONS Segetis, Inc. (US) 2010-07-14 EP disclosed
EP-2185625-A1 KETAL COMPOUNDS FROM POLYOLS AND OXOCARBOXYLATES Segetis, Inc. (US) 2010-05-19 EP disclosed
WO-2009146202-A2 TRANSKETALIZED COMPOSITIONS, SYNTHESIS, AND APPLICATIONS SEGETIS, INC. (US) 2009-12-03 WO disclosed
WO-2009048874-A1 METHOD OF MAKING KETALS AND ACETALS SEGETIS, INC. (US) 2009-04-16 WO disclosed
WO-2009049041-A2 POLYKETAL COMPOUNDS, SYNTHESIS, AND APPLICATIONS SEGETIS, INC. (US) 2009-04-16 WO disclosed
WO-2009032905-A1 KETAL COMPOUNDS FROM POLYOLS AND OXOCARBOXYLATES SEGETIS, INC. (US) 2009-03-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120136070-A1 KETAL ESTERS OF ANHYDROPENTITOLS AND USES THEREOF KHK, HKDC1, HK2 PGK1 221/4885PGK2 155/4885FDPS 659/4885
US-20140135455-A1 TRANSKETALIZED COMPOSITIONS, SYNTHESIS, AND APPLICATIONS TKT, KHK, KYAT3 PGK1 61/4885PGK2 54/4885FDPS 301/4885
US-20120157560-A1 KETAL ESTERS OF ANHYDROPENTITOLS AND USES THEREOF KHK, HKDC1, HK2 PGK1 221/4885PGK2 155/4885FDPS 659/4885
US-20100292491-A1 Method of Making Ketals and Acetals KAT6B, KAT5, ADH1C PGK1 375/4885PGK2 285/4885FDPS 3812/4885
US-20150291567-A1 TRANSKETALIZED COMPOSITIONS, SYNTHESIS, AND APPLICATIONS TKT, KHK, KYAT3 PGK1 61/4885PGK2 54/4885FDPS 301/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.