SCHEMBL8465616

SCHEMBL8465616

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

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.46
LMNA P02545 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
USP2 O75604 1/20 0.43
SLCO1B1 Q9Y6L6 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.35
OR51E2 Q9H255 1/20 0.33
KDM4E B2RXH2 2/20 0.32
CPT2 P23786 1/20 0.30
ACLY P53396 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
SCHEMBL16798768 0.88 PDE4A (0.41) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL29162767 0.88 PDE4A (0.41) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL5859311 0.88 PDE4A (0.41) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL7534971 0.86 PDE4A (0.39) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL9763747 0.82 USP2 (0.48) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL18825609 0.82 USP2 (0.48) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL29159266 0.82 USP2 (0.48) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL7025484 0.80 USP2 (0.47) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL8356023 0.80 USP2 (0.47) PDE4ALMNAL3MBTL1USP2SLCO1B1
SCHEMBL28449969 0.80 USP2 (0.47) PDE4ALMNAL3MBTL1USP2SLCO1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0753503-B1 Process for preparation of xylaric acid and use thereof ROQUETTE FRERES (FR) 1999-06-09 EP disclosed
EP-0753503-A1 Process for preparation of xylaric acid and use thereof Roquette Frˬres (FR) 1997-01-15 EP disclosed
US-5584944-A FRICTION RESISTANCE; LOW TEMPERATURE DRYING; BEVERAGE CONTAINERS HENKEL CORPORATION (US) 1996-12-17 US disclosed
US-5486316-A Aqueous lubricant and surface conditioner for formed metal surfaces HENKEL CORPORATION (US) 1996-01-23 US disclosed
US-5476601-A Additive consists of quaternary ammonium salt and amine oxide, complex fluoride ions, optionally phosphate ions including sulfate and nitrate ions, aluminate anion and aluminum cation, water solulbe polymer and antifome agent HENKEL CORPORATION (US) 1995-12-19 US disclosed
US-5458698-A Aluminum and tin beverage containers HENKEL CORPORATION (US) 1995-10-17 US disclosed