SCHEMBL5596103

SCHEMBL5596103

O=c1[nH]cccc1O.[Al]

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
SCHEMBL82455 0.97
SCHEMBL9517333 0.95
SCHEMBL29127320 0.95
SCHEMBL692818 0.95
SCHEMBL30482581 0.95
SCHEMBL4286239 0.95
Ammonia Solution, Strong SCHEMBL17005900 0.95
Naphthalene SCHEMBL11343213 0.89 DAO (0.83)
Carbamic Acid SCHEMBL8959472 0.87 DAO (0.79)
Monoethanolamine SCHEMBL29098665 0.83 DAO (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007302707-A NEW PHOSPHOR MATERIAL, LIGHT-EMITTING MATERIAL AND PHOSPHORESCENT PIGMENT CONTAINING THE PHOSPHOR MATERIAL OSAKA UNIV 2007-11-22 JP disclosed