SCHEMBL23028705

SCHEMBL23028705

N=C(N)NCCC(=O)OCCc1c[nH]nn1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
TOP2A P11388 1/20 0.30
LMNA P02545 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
SCHEMBL23028706 0.82 ST14 (0.35) LMNA
SCHEMBL23028588 0.79 TDP1 (0.38) ALDH1A1LMNA
SCHEMBL23028695 0.79
SCHEMBL23028593 0.77 TDP1 (0.33)
SCHEMBL23028590 0.76
SCHEMBL29411782 0.76 LMNA (0.39) GLALMNA
SCHEMBL23028704 0.75 ST14 (0.35)
SCHEMBL23028672 0.74 ADRA2A (0.33) ALDH1A1
SCHEMBL23028650 0.71 POLB (0.30)
SCHEMBL23028688 0.70

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
WO-2021034548-A1 MITOCHONDRIAL MODULATION TO IMPROVE METABOLIC SYNDROME DURING AGING THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2021-02-25 WO disclosed