SCHEMBL21135599

SCHEMBL21135599

CN(CCOOCCN(CCO)C1CC(C)(C)N(O)C(C)(C)C1)C1CC(C)(C)N(O)C(C)(C)C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL5697626 0.84 GAA (0.38) ALDH1A1ALOX15
SCHEMBL16404585 0.81 ALDH1A1 (0.40) ALDH1A1ALOX15
SCHEMBL537264 0.71
SCHEMBL16679069 0.71
SCHEMBL6158870 0.70
SCHEMBL9439172 0.70 MAOB (0.30)
SCHEMBL7913119 0.68
SCHEMBL21236032 0.67 GAA (0.40) ALDH1A1ALOX15
SCHEMBL9129658 0.66 MAPT (0.31)
SCHEMBL7913138 0.66

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-3310819-B1 COMPOSITION FOR IMMEDIATELY ENDING RADICAL POLYMERIZATION BASF SE (DE) 2019-06-12 EP disclosed