SCHEMBL5134463

SCHEMBL5134463

CCCC([CH]C=O)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
SCHEMBL1665543 0.83
SCHEMBL12896236 0.75 TRPA1 (0.35)
SCHEMBL27369265 0.74
SCHEMBL550997 0.74
SCHEMBL7284358 0.70
SCHEMBL14010386 0.67
SCHEMBL514688 0.65
SCHEMBL3463522 0.65 TSHR (0.48)
SCHEMBL3534897 0.64
SCHEMBL10432807 0.63 ADH1B (0.50)

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-1740640-A4 DIBENZODIAZOCINE POLYMERS SOLVAY ADVANCED POLYMERS LLC (US) 2008-06-04 EP claimed
JP-2007535591-A 2007-12-06 JP claimed
US-7238771-B2 Dibenzodiazocine polymers SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2007-07-03 US claimed
EP-1740640-A2 DIBENZODIAZOCINE POLYMERS Solvay Advanced Polymers, L.L.C. (US) 2007-01-10 EP claimed
US-20060058499-A1 Dibenzodiazocine polymers SOLVAY ADVANCED POLYMERS, L.L.C. 2006-03-16 US claimed
WO-2005105922-A2 DIBENZODIAZOCINE POLYMERS SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2005-11-10 WO claimed