SCHEMBL3834760

SCHEMBL3834760

[CH2]C(O)C(O)C(C)=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8149855 0.81
SCHEMBL14366518 0.78 LMNA (0.42)
SCHEMBL58897 0.78 LMNA (0.42)
SCHEMBL10759511 0.78
SCHEMBL5586687 0.74
SCHEMBL13997319 0.72 LMNA (0.36)
SCHEMBL17574431 0.72 LMNA (0.36)
SCHEMBL5936391 0.72 LMNA (0.36)
SCHEMBL12572606 0.72 LMNA (0.36)
SCHEMBL14116702 0.69

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
WO-2000003699-A2 DRUGS CONTAINING PHOSPHORIC ACID DERIVATIVES AS ACTIVE INGREDIENT AND THEIR USE HASSAN JOMAA (DE) 2000-01-27 WO claimed
EP-1549658-B1 GLUCOSE-BASED COMPOUNDS WITH AFFINITY TO P-SELECTIN ASTELLAS PHARMA EUROP B V (NL) 2009-09-30 EP disclosed
US-7304039-B2 Glucose-based compounds with affinity to P-selectin ASTELLAS PHARMA EUROPE B.V. (NL) 2007-12-04 US disclosed
US-20050261207-A1 Glucose-based compounds with affinity to p-selectin YAMANOUCHI EUROPE B.V. (NL) 2005-11-24 US disclosed
EP-1549658-A1 GLUCOSE-BASED COMPOUNDS WITH AFFINITY TO P-SELECTIN YAMANOUCHI EUROPE B.V. (NL) 2005-07-06 EP disclosed
WO-2004033473-A1 GLUCOSE-BASED COMPOUNDS WITH AFFINITY TO P-SELECTIN YAMANOUCHI EUROPE B.V. (NL) 2004-04-22 WO disclosed