SCHEMBL28093271

SCHEMBL28093271

O=C(OC(=O)[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O)[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IDUA P35475 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
SCHEMBL3821278 1.00 IDUA (0.31) IDUA
SCHEMBL9556151 0.98
SCHEMBL28641674 0.91
SCHEMBL28242019 0.89 IDUA (0.32) IDUA
SCHEMBL27966923 0.87
SCHEMBL1950301 0.87 ALDH1A1 (0.35)
Acetic Acid SCHEMBL27310914 0.84 ALDH1A1 (0.32)
SCHEMBL1820162 0.84
SCHEMBL27894551 0.82 TSHR (0.30)
SCHEMBL28064418 0.82

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-111433176-A Probes for selective characterization of enzymes involved in xenobiotic metabolism and methods of making and using the same 巴特尔纪念研究院 2020-07-17 CN disclosed
CN-106459995-A CRISPR-associated methods and compositions using dominant grnas 爱迪塔斯医药有限公司 2017-02-22 CN disclosed
CN-104292364-B A kind of method extracting bioactive substance from egg shell membrane 浙江大学 2016-08-03 CN disclosed