SCHEMBL3744813

SCHEMBL3744813

CCC(OC)C(O)CO

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
SCHEMBL3797668 0.83
SCHEMBL811246 0.83
SCHEMBL1682659 0.83
SCHEMBL18043562 0.83
SCHEMBL27865467 0.81 MGAM (0.41)
SCHEMBL2303494 0.81 TSHR (0.41)
SCHEMBL9736288 0.80 LMNA (0.33)
SCHEMBL12192226 0.80 TSHR (0.32)
SCHEMBL13951959 0.79
Methoxymethane SCHEMBL27543746 0.78 LMNA (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2898028-A1 AQUEOUS COMPOSITION FOR INKJET PRINTING, AND ITS USE FOR DECORATION OF CERAMIC MATERIALS System S.p.A. (IT) 2015-07-29 EP disclosed
WO-2014045192-A1 AQUEOUS COMPOSITION FOR INKJET PRINTING, AND ITS USE FOR DECORATION OF CERAMIC MATERIALS SYSTEM S.P.A. (IT) 2014-03-27 WO disclosed
US-7833289-B1 Hair care component and method of manufacture for use in a hair coloring system Alterna Holdings Corporation (US) 2010-11-16 US disclosed