SCHEMBL3453979

SCHEMBL3453979

CC(N)C#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
SCHEMBL2267702 0.76
SCHEMBL27077 0.69
SCHEMBL31688079 0.69
SCHEMBL11668513 0.67
SCHEMBL148913 0.67
SCHEMBL9452502 0.67
SCHEMBL759891 0.67
SCHEMBL8284153 0.67
SCHEMBL6014582 0.65
Ethylene SCHEMBL10717356 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1477533-B1 Process for application of an aqueous phase paint product CANDIS SRL (IT) 2010-12-22 EP disclosed
EP-1424321-B1 Synthesis of optically active cyclohexylphenylglycolate esters SEPRACOR INC (US) 2006-07-05 EP disclosed
EP-1477533-A2 Process for application of an aqueous phase paint product Candis S.r.l. (IT) 2004-11-17 EP disclosed
EP-1004638-B1 Aqueous-phase painting product, production process thereof and kit usable in this process CANDIS SRL (IT) 2004-11-10 EP disclosed
EP-1004638-A2 Aqueous-phase painting product, production process thereof and kit usable in this process C.A.N.D.I.S.S. CHIMICA APPLICATA NORD ITALIA DI GILLI ALBERTO (IT) 2000-05-31 EP disclosed