SCHEMBL9400689

SCHEMBL9400689

NCC(=O)OC[C@@H](OCC(O)CO)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
KDM4E B2RXH2 1/20 0.36
DUSP3 P51452 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
USP2 O75604 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
PDE4A P27815 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
DGKA P23743 1/20 0.31
FAAH O00519 2/20 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
SCHEMBL3705601 0.80 LMNA (0.44) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL1287894 0.80 LMNA (0.44) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL351117 0.78 LMNA (0.52) LMNAKDM4EDUSP3MEN1KMT2A
Demannose SCHEMBL28547923 0.78 LMNA (0.38) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL23151858 0.77 USP2 (0.39) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL28029290 0.76 LMNA (0.50) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL10628051 0.76 LMNA (0.48) LMNAKDM4EUSP2SLCO1B1PDE4A
SCHEMBL23151848 0.73 ALDH1A1 (0.34) LMNAKDM4EDUSP3MEN1KMT2A
1,3-Propanediol SCHEMBL8603394 0.72 KDM4E (0.50) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL11198258 0.72 USP2 (0.42) LMNAKDM4EUSP2SLCO1B1PDE4A

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-5374551-A Measurement of metabolism of alpha-methyl glucoside BIOLOG, INC. (US) 1994-12-20 US disclosed