SCHEMBL17010883

SCHEMBL17010883

CC(N)NC(C)CCC=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL7676924 0.80 TDP1 (0.35) ADH1BADH1CADH1AALDH1A1
SCHEMBL4379959 0.74
SCHEMBL10306801 0.74
SCHEMBL22746311 0.72
SCHEMBL7678163 0.72
SCHEMBL2409761 0.70
SCHEMBL7676857 0.68
SCHEMBL107778 0.68
SCHEMBL3459368 0.68
SCHEMBL12898291 0.68 HIF1A (0.39) ALDH1A1

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
US-9109070-B2 Nanoparticles with multiple attached polymer assemblies and use thereof in polymer composites UNIVERSITY OF SOUTH CAROLINA (US) 2015-08-18 US disclosed