SCHEMBL22692162

SCHEMBL22692162

O=C[C@H](O)[C@H](OF)[C@H](O)CO

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.37
MPI P34949 1/20 0.35
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL8857020 0.88 LMNA (0.39) AKR1B1MPILMNAL3MBTL1
SCHEMBL458800 0.88 AKR1B1 (0.34) AKR1B1MPILMNAL3MBTL1
SCHEMBL458623 0.88 LMNA (0.39) AKR1B1MPILMNAL3MBTL1
SCHEMBL309709 0.88 LMNA (0.39) AKR1B1MPILMNAL3MBTL1
SCHEMBL5453628 0.83 AKR1B1 (0.37) AKR1B1MPILMNAL3MBTL1
SCHEMBL3142523 0.83 AKR1B1 (0.37) AKR1B1MPILMNAL3MBTL1
SCHEMBL5770928 0.83 AKR1B1 (0.37) AKR1B1MPILMNAL3MBTL1
SCHEMBL183626 0.83 AKR1B1 (0.37) AKR1B1MPILMNAL3MBTL1
SCHEMBL5771370 0.83 AKR1B1 (0.37) AKR1B1MPILMNAL3MBTL1
SCHEMBL4750910 0.81 AKR1B1 (0.36) AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114787286-A Dicationic fluorescent dyes 豪夫迈·罗氏有限公司 2022-07-22 CN disclosed
CN-114269332-A Compositions and methods relating to tethered ethoxydihydroxybutanone derivatives 芝加哥大学 2022-04-01 CN disclosed
CN-112367988-A Compositions and methods relating to ethoxydihydroxybutanone derivatives 芝加哥大学 2021-02-12 CN disclosed
WO-2020237262-A1 COMPOSITIONS AND METHODS RELATED TO TETHERED KETHOXAL DERIVATIVES THE UNIVERSITY OF CHICAGO (US) 2020-11-26 WO disclosed
CN-102918147-B Improved detection of RNase H and nucleic acid amplification 韩华泰科株式会社 2017-04-12 CN disclosed