SCHEMBL3900672

SCHEMBL3900672

O=C1C[C@H](O)[C@@H](O)C1

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
SCHEMBL3310184 1.00
SCHEMBL3899974 1.00
SCHEMBL3136461 0.86 MEN1 (0.38)
SCHEMBL3127579 0.86 MEN1 (0.38)
SCHEMBL14524980 0.81
SCHEMBL14348202 0.81
SCHEMBL5277725 0.77
SCHEMBL23927965 0.74
SCHEMBL16581458 0.74 MEN1 (0.36)
SCHEMBL18922081 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773740-B1 NEUROLOGICALLY-ACTIVE COMPOUNDS UNIV SYDNEY (AU) 2009-02-18 EP disclosed
US-20080032950-A1 Neurologically-Active Compounds THE UNIVERSITY OF SYDNEY (AU) 2008-02-07 US disclosed
US-20080032950-A1 Neurologically-Active Compounds THE UNIVERSITY OF SYDNEY (AU) 2008-02-07 US disclosed
US-20080032950-A1 Neurologically-Active Compounds THE UNIVERSITY OF SYDNEY (AU) 2008-02-07 US disclosed
EP-1773740-A4 NEUROLOGICALLY-ACTIVE COMPOUNDS UNIV SYDNEY (AU) 2007-09-19 EP disclosed
EP-1773740-A1 NEUROLOGICALLY-ACTIVE COMPOUNDS THE UNIVERSITY OF SYDNEY (AU) 2007-04-18 EP disclosed
WO-2006000043-A1 NEUROLOGICALLY-ACTIVE COMPOUNDS THE UNIVERSITY OF SYDNEY (AU) 2006-01-05 WO disclosed