SCHEMBL11228161

SCHEMBL11228161

CC(N)CNCC(O)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.74
L3MBTL1 Q9Y468 1/20 0.74
AOC3 Q16853 4/20 0.58
ALDH1A1 P00352 2/20 0.54
KMT2A Q03164 1/20 0.53
BCAT2 O15382 1/20 0.51
LMNA P02545 3/20 0.50
ADRA2A P08913 1/20 0.47
ADRA2C P18825 1/20 0.47
HIF1A Q16665 1/20 0.47

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
SCHEMBL15355176 1.00 KDM4E (0.74) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
SCHEMBL4408535 0.86 KDM4E (1.00) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
SCHEMBL7532494 0.86 KDM4E (1.00) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
SCHEMBL12186411 0.85 KDM4E (0.80) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
SCHEMBL7114926 0.85 KDM4E (0.80) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
SCHEMBL8976776 0.83 KDM4E (0.77) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
SCHEMBL9061582 0.83 KDM4E (0.77) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
Acetic Acid SCHEMBL8948216 0.81 KDM4E (0.80) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
SCHEMBL353927 0.80 KDM4E (0.65) KDM4EL3MBTL1AOC3ALDH1A1KMT2A
SCHEMBL353926 0.80 KDM4E (0.65) KDM4EL3MBTL1AOC3ALDH1A1KMT2A

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-4315846-A FUNGICIDES TOKYO ORGANIC CHEMICAL INDUSTRIES, LTD. (JP) 1982-02-16 US disclosed