SCHEMBL20798014

SCHEMBL20798014

O=C(CO)COP(=O)(O)OCC(=O)COP(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TPI1 P60174 2/20 0.43
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
MVD P53602 1/20 0.33
BTN3A1 O00481 1/20 0.32
PGD P52209 2/20 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
SCHEMBL43277 0.91 TPI1 (0.50) TPI1PGK1PGK2PGD
SCHEMBL29018985 0.91 TPI1 (0.34) TPI1MVDBTN3A1
SCHEMBL29156118 0.89 TPI1 (0.48) TPI1PGK1PGK2PGD
Hydrogen Peroxide SCHEMBL28079410 0.89 TPI1 (0.48) TPI1PGK1PGK2MVDPGD
Water SCHEMBL28701484 0.89 TPI1 (0.48) TPI1PGK1PGK2BTN3A1PGD
SCHEMBL28769882 0.89 TPI1 (0.48) TPI1PGK1PGK2PGD
SCHEMBL5485133 0.83 TPI1 (0.56) TPI1PGK1PGK2PGD
SCHEMBL5485138 0.83 MVD (0.47) MVDBTN3A1
SCHEMBL10876378 0.79 MVD (0.45) MVDBTN3A1
SCHEMBL15150489 0.78 PLA2G2A (0.34) TPI1MVDBTN3A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116087486-B Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2024-02-02 CN disclosed
CN-116087485-B Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2023-10-20 CN disclosed
CN-116087488-A Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2023-05-09 CN disclosed
CN-116087487-A Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2023-05-09 CN disclosed
CN-116087486-A Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2023-05-09 CN disclosed
CN-116087489-A Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2023-05-09 CN disclosed
CN-116087485-A Biomarkers for early prediction of cardiovascular disease (CVD) in diabetics and uses thereof 中国医学科学院阜外医院 2023-05-09 CN disclosed
EP-3679065-A1 SIGNALING AND ANTIGEN-PRESENTING BIFUNCTIONAL RECEPTORS (SABR) California Institute of Technology (US) 2020-07-15 EP disclosed
WO-2019051001-A1 SIGNALING AND ANTIGEN-PRESENTING BIFUNCTIONAL RECEPTORS (SABR) CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2019-03-14 WO disclosed