SCHEMBL28870744

SCHEMBL28870744

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

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
TET2 Q6N021 1/20 0.33
TSHR P16473 6/20 0.32
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
DGAT1 O75907 1/20 0.31
HSD17B10 Q99714 1/20 0.30
TP53 P04637 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
SCHEMBL674034 0.92 ALDH1A1 (0.39) ALDH1A1MGAMGAASIMGAM2
SCHEMBL242271 0.81 GAA (0.39) ALDH1A1MGAMGAASIMGAM2
SCHEMBL4906137 0.79 ALDH1A1 (0.37) ALDH1A1TSHRTHRB
SCHEMBL27651542 0.77 ALDH1A1 (0.42) ALDH1A1TSHRTHRB
SCHEMBL2420651 0.77 USP2 (0.37) MGAMGAASIMGAM2TET2
SCHEMBL4908122 0.77 TSHR (0.39) ALDH1A1TSHRLMNA
SCHEMBL13559183 0.76 GAA (0.41) ALDH1A1MGAMGAASIMGAM2
SCHEMBL2905563 0.76 USP2 (0.36) MGAMGAASIMGAM2TET2
SCHEMBL11750768 0.75 GAA (0.34) ALDH1A1MGAMGAASIMGAM2
SCHEMBL17050953 0.75 ALDH1A1 (0.33) ALDH1A1MGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109535294-B Polymer containing trimethyl citrate methacrylate monomer unit and application thereof in removing heavy metal ions 中国医学科学院药用植物研究所 2021-03-26 CN claimed
CN-109535294-B Polymer containing trimethyl citrate methacrylate monomer unit and application thereof in removing heavy metal ions 中国医学科学院药用植物研究所 2021-03-26 CN disclosed
CN-109535294-A A kind of polymer containing citric acid methacrylate monomers unit and its application in heavy-metal ion removal 中国医学科学院药用植物研究所 2019-03-29 CN disclosed