SCHEMBL28108170

SCHEMBL28108170

O=C(O)C(OS(=O)(=O)O)C(OS(=O)(=O)O)C(=O)O.[MgH2].[MgH2]

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.33
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL21045764 0.97 CA2 (0.35) CA2SLC1A3SLC1A2SLC1A1TSHR
SCHEMBL1794070 0.82 TSHR (0.41) TSHR
Benzene SCHEMBL9474100 0.79 TSHR (0.38) TSHR
SCHEMBL11516838 0.74 TP53 (0.35) CA2TDP1
SCHEMBL4896921 0.73 PDE4A (0.48) TDP1
SCHEMBL6523961 0.72 ALDH1A1 (0.46) SLC1A3SLC1A2SLC1A1TSHR
SCHEMBL28236598 0.72 CA1 (0.43) CA2SLC1A3SLC1A2SLC1A1TSHR
SCHEMBL11276029 0.72 TSHR (0.33) CA2TSHRTDP1
SCHEMBL31149010 0.70 TP53 (0.36) CA2TDP1
SCHEMBL2329722 0.70 TP53 (0.36) CA2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106196890-B A kind of dry color-retention method of petal plane 绍兴文理学院元培学院 2019-03-29 CN disclosed
CN-106196890-A A kind of petal plane is dried color-retention method 绍兴文理学院元培学院 2016-12-07 CN disclosed