SCHEMBL8516941

SCHEMBL8516941

CC(O)C#CO.CC(O)OC(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
SCHEMBL29165412 0.88
SCHEMBL148913 0.85
Methoxymethane SCHEMBL28270172 0.82
Hydrochloric Acid SCHEMBL29099793 0.82
Water SCHEMBL28574141 0.82
Boric Acid SCHEMBL7466602 0.77
SCHEMBL40263 0.74
Acetic Acid SCHEMBL11223713 0.72 FFAR3 (0.39)
Ammonia Solution, Strong SCHEMBL28208580 0.71
SCHEMBL28930120 0.70

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-0891399-B1 NEUTRAL REMOVERS OF PAINT FROM ESSENTIALLY METALLIC SURFACES VE CO S R L (IT) 1999-12-15 EP claimed
EP-0891399-A1 NEUTRAL REMOVERS OF PAINT FROM ESSENTIALLY METALLIC SURFACES Ve.Co S.R.L. (IT) 1999-01-20 EP claimed
WO-1997038057-A1 NEUTRAL REMOVERS OF PAINT FROM ESSENTIALLY METALLIC SURFACES VE.CO S.R.L. (IT) 1997-10-16 WO claimed
EP-0891399-B1 NEUTRAL REMOVERS OF PAINT FROM ESSENTIALLY METALLIC SURFACES VE CO S R L (IT) 1999-12-15 EP disclosed
EP-0891399-A1 NEUTRAL REMOVERS OF PAINT FROM ESSENTIALLY METALLIC SURFACES Ve.Co S.R.L. (IT) 1999-01-20 EP disclosed
WO-1997038057-A1 NEUTRAL REMOVERS OF PAINT FROM ESSENTIALLY METALLIC SURFACES VE.CO S.R.L. (IT) 1997-10-16 WO disclosed