SCHEMBL18900992

SCHEMBL18900992

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

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
ALOX15 P16050 1/20 0.41
GAA P10253 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PKM P14618 1/20 0.33

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
SCHEMBL18900991 0.91 ALDH1A1 (0.45) ALDH1A1ALOX15GAAL3MBTL1PKM
SCHEMBL9456654 0.89
SCHEMBL14372113 0.78 GAA (0.44) ALDH1A1ALOX15GAAL3MBTL1
SCHEMBL1401924 0.78 ALDH1A1 (0.45) ALDH1A1ALOX15GAAL3MBTL1PKM
SCHEMBL18371419 0.76 GAA (0.45) ALDH1A1ALOX15GAAL3MBTL1PKM
SCHEMBL2168632 0.75
SCHEMBL21163316 0.75 GAA (0.46) ALDH1A1ALOX15GAAL3MBTL1PKM
SCHEMBL21163048 0.72
SCHEMBL11332858 0.71
SCHEMBL18901300 0.71 GAA (0.43) ALDH1A1ALOX15GAAL3MBTL1PKM

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-2013240-B1 PROCESS FOR THE PREPARATION OF CROSSLINKED NITROXIDE POLYMERS PIOTREK CO LTD (JP) 2017-05-31 EP disclosed