SCHEMBL825405

SCHEMBL825405

CCN1CCNCC[N+](Cc2nccn2C)(Cc2nccn2C)CC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 1/20 0.33
TLR7 Q9NYK1 1/20 0.32
CXCR4 P61073 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL825254 0.87 SOD3 (0.41) CXCR4
SCHEMBL825303 0.87 FDPS (0.32) MAPKAPK2
SCHEMBL7492912 0.79 EGLN1 (0.41) MAPKAPK2TLR7
SCHEMBL209630 0.73 EGLN1 (0.44) CXCR4
SCHEMBL7462242 0.72 EGLN1 (0.44) CXCR4
SCHEMBL7613456 0.72 EGLN1 (0.44) CXCR4
SCHEMBL825324 0.71 CHRNA7 (0.34)
SCHEMBL1332937 0.69 EGLN1 (0.44)
SCHEMBL20328914 0.69 EGLN1 (0.44)
SCHEMBL825294 0.68 HRH3 (0.46)

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-2521750-A1 CURING LIQUIDS OMG Additives Limited (GB) 2012-11-14 EP claimed
WO-2011083309-A1 CURING LIQUIDS UNILEVER PLC (GB) 2011-07-14 WO claimed
EP-2582744-A1 ACCELERATOR SOLUTION AND PROCESS FOR CURING CURABLE RESINS Akzo Nobel Chemicals International B.V. (NL) 2013-04-24 EP disclosed
EP-2521750-A1 CURING LIQUIDS OMG Additives Limited (GB) 2012-11-14 EP disclosed
WO-2011157673-A1 ACCELERATOR SOLUTION AND PROCESS FOR CURING CURABLE RESINS AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2011-12-22 WO disclosed
WO-2011083309-A1 CURING LIQUIDS UNILEVER PLC (GB) 2011-07-14 WO disclosed