SCHEMBL6817366

SCHEMBL6817366

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

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.43
LMNA P02545 2/20 0.41
USP2 O75604 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
OR51E2 Q9H255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 2/20 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
SCHEMBL29879125 1.00 PDE4A (0.43) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL4280412 0.87 PDE4A (0.37) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL6813499 0.80 LMNA (0.42) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL2773023 0.79 PDE4A (0.43) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL31542046 0.79 LMNA (0.36) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL9763747 0.78 USP2 (0.48) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL29159266 0.78 USP2 (0.48) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL8465616 0.78 PDE4A (0.46) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL18825609 0.78 USP2 (0.48) PDE4ALMNAUSP2SLCO1B1L3MBTL1
SCHEMBL8356023 0.77 USP2 (0.47) PDE4ALMNAUSP2SLCO1B1L3MBTL1

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
EP-1227789-B1 IMPROVED DUAL PHASE STANNOUS ORAL COMPOSITIONS PROCTER & GAMBLE (US) 2004-09-22 EP claimed
CN-115337242-A Traditional Chinese medicine composition, extract, preparation method and application thereof, cosmetics and medicines 新生活化妆品科技(上海)有限公司 2022-11-15 CN disclosed
EP-1227789-B1 IMPROVED DUAL PHASE STANNOUS ORAL COMPOSITIONS PROCTER & GAMBLE (US) 2004-09-22 EP disclosed
EP-1227789-A1 IMPROVED DUAL PHASE STANNOUS ORAL COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2002-08-07 EP disclosed
WO-2001034109-A1 IMPROVED DUAL PHASE STANNOUS ORAL COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-05-17 WO disclosed