SCHEMBL21617331

SCHEMBL21617331

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

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.57
LMNA P02545 2/20 0.44
USP2 O75604 1/20 0.44
SLCO1B1 Q9Y6L6 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 2/20 0.38
CYP2C9 P11712 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
OR51E2 Q9H255 1/20 0.34
KDM4E B2RXH2 2/20 0.33
PGD P52209 1/20 0.33
TGFBR1 P36897 1/20 0.32

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
SCHEMBL22806520 0.94 PDE4A (0.55) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL22806523 0.90 PDE4A (0.50) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Xylose SCHEMBL21590122 0.85 PDE4A (0.46) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Xylose SCHEMBL27863624 0.85 PDE4A (0.46) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL14621237 0.84 PDE4A (0.57) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL20557370 0.84 PDE4A (0.57) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL13457663 0.82 PDE4A (0.36) PDE4ALMNAUSP2SLCO1B1TSHR
SCHEMBL1133254 0.82 PDE4A (0.59) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL17708449 0.81 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL22806539 0.81 PDE4A (0.39) PDE4ATSHRCYP2C9OR51E2PGD

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-114729365-A Methods and compositions for editing nucleotide sequences 布罗德研究所股份有限公司 2022-07-08 CN disclosed
CN-114127285-A Methods and compositions for editing nucleotide sequences 布罗德研究所股份有限公司 2022-03-01 CN disclosed
CN-113891937-A Methods and compositions for editing nucleotide sequences 布罗德研究所股份有限公司 2022-01-04 CN disclosed
CN-113891936-A Methods and compositions for editing nucleotide sequences 布罗德研究所股份有限公司 2022-01-04 CN disclosed
CN-113473977-A Cannabidiol and/or derivatives thereof for use in the treatment of mitochondrial diseases 巴塞罗那自治大学 2021-10-01 CN disclosed
US-20210292290-A1 PROCESS FOR THE PRODUCTION AND SEPARATION OF 5-HYDROXYMETHYLFURFURAL WITH QUATERNARY AMMONIUM SALTS NOVAMONT S.P.A. (IT) 2021-09-23 US disclosed
EP-3820855-A1 PROCESS FOR THE PRODUCTION AND SEPARATION OF 5- HYDROXYMETHYLFURFURAL WITH QUATERNARY AMMONIUM SALTS Novamont S.p.A. (IT) 2021-05-19 EP disclosed
CN-112424179-A Method for producing and separating 5-hydroxymethylfurfural by using quaternary ammonium salt 诺瓦蒙特股份公司 2021-02-26 CN disclosed
WO-2020011996-A1 PROCESS FOR THE PRODUCTION AND SEPARATION OF 5- HYDROXYMETHYLFURFURAL WITH QUATERNARY AMMONIUM SALTS NOVAMONT S.P.A. (IT) 2020-01-16 WO disclosed