SCHEMBL5822339

SCHEMBL5822339

O=C1CCCC(=O)CCC1.O=C1CCCC(=O)CCC1.[Ni]

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.75
TRIM33 Q9UPN9 2/20 0.75
ALDH1A1 P00352 1/20 0.69
CRBN Q96SW2 1/20 0.41
ESR2 Q92731 1/20 0.31
OR51E2 Q9H255 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
SCHEMBL1566729 0.95 TRIM24 (0.82) TRIM24TRIM33ALDH1A1CRBNESR2
SCHEMBL27625504 0.95 TRIM24 (0.82) TRIM24TRIM33ALDH1A1CRBNESR2
SCHEMBL3700651 0.91
Cyclopentanone SCHEMBL27575848 0.91 TRIM24 (0.91) TRIM24TRIM33ALDH1A1CRBNESR2
SCHEMBL5860219 0.91 TRIM24 (0.91) TRIM24TRIM33ALDH1A1CRBNESR2
SCHEMBL276387 0.91
SCHEMBL9323692 0.91
SCHEMBL21925249 0.87 ALDH1A1 (0.92) TRIM24TRIM33ALDH1A1CRBNESR2
SCHEMBL21925250 0.87 ALDH1A1 (0.92) TRIM24TRIM33ALDH1A1CRBNESR2
SCHEMBL5069700 0.87 ALDH1A1 (0.92) TRIM24TRIM33ALDH1A1CRBNESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1707263-A1 Catalyst composition comprising an alkylene diamine-nickel complex and process for producing a cross-coupled compound using the same Tosoh Corporation (JP) 2006-10-04 EP disclosed