SCHEMBL587342

SCHEMBL587342

CCCCOC#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
SCHEMBL2919593 0.83 ADRB2 (0.45)
SCHEMBL3517705 0.78
SCHEMBL20658210 0.78 ADRB2 (0.41)
SCHEMBL2984916 0.76
SCHEMBL390994 0.76 ADRB2 (0.39)
SCHEMBL5561182 0.74
SCHEMBL2984055 0.74
SCHEMBL20658161 0.72 THRB (0.47)
SCHEMBL2990615 0.72 ADRB2 (0.36)
SCHEMBL3520024 0.71 ADRB2 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229420-B1 USE OF HYDROPHOBIC SOLVENT-BASED PIGMENT PREPARATIONS IN ELECTRONIC DISPLAYS CLARIANT FINANCE BVI LTD (VG) 2012-02-15 EP disclosed
US-20110012072-A1 Use of Hydrophobic Solvent-Based Pigment Preparations in Electronic Displays CLARIANT FINANCE (BVI) LIMITED (VG) 2011-01-20 US disclosed
EP-2229420-A2 USE OF HYDROPHOBIC SOLVENT-BASED PIGMENT PREPARATIONS IN ELECTRONIC DISPLAYS Clariant Finance (BVI) Limited (VG) 2010-09-22 EP disclosed
WO-2009086868-A2 USE OF HYDROPHOBIC SOLVENT-BASED PIGMENT PREPARATIONS IN ELECTRONIC DISPLAYS CLARIANT INTERNATIONAL LTD (CH) 2009-07-16 WO disclosed