SCHEMBL3669733

SCHEMBL3669733

CC(CCN=C=O)CC(C)(C)N=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
SCHEMBL3266895 0.89
SCHEMBL28711148 0.81
SCHEMBL1123499 0.81 MEN1 (0.30)
SCHEMBL13430217 0.78
SCHEMBL19006017 0.78
SCHEMBL37901 0.78
SCHEMBL231391 0.77
SCHEMBL6677284 0.76
SCHEMBL14285774 0.76 CYP2D6 (0.31)
SCHEMBL21407387 0.74

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
US-8318869-B2 Fluorinated polyurethane composition SOLVAY SOLEXIS S.P.A. (IT) 2012-11-27 US disclosed
US-20100311893-A1 Fluorinated polyurethane composition SOLVAY SOLEXIS S.P.A. (IT) 2010-12-09 US disclosed
EP-2158239-A1 FLUORINATED POLYURETHANE COMPOSITION Solvay Solexis S.p.A. (IT) 2010-03-03 EP disclosed
WO-2008138927-A1 FLUORINATED POLYURETHANE COMPOSITION SOLVAY SOLEXIS S.P.A. (IT) 2008-11-20 WO disclosed
US-7329367-B2 Enhancement of durable soil release and soil resist, stain resist water and oil repellency and the softness of fibrous substrates, the substrates so treated and the treating composition TRICHROMATIC CARPET INC. (CA) 2008-02-12 US disclosed
US-20060062968-A1 Enhancement of durable soil release and soil resist, stain resist water and oil repellency and the softness of fibrous substrates, the substrates so treated and the treating composition TRI-TEXCO INC. (CA) 2006-03-23 US disclosed