SCHEMBL24724735

SCHEMBL24724735

CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1ccc(CNc2nc(NCC3CCCCC3)nc(NC3CC4CCC3C4)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ENO1 P06733 1/20 0.43
DGAT1 O75907 1/20 0.37
BRS3 P32247 1/20 0.36
HDAC6 Q9UBN7 1/20 0.35
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
ADORA2B P29275 1/20 0.35
ACACB O00763 2/20 0.35
ACACA Q13085 2/20 0.35

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
SCHEMBL23386772 0.89 ENO1 (0.55) ENO1HDAC6
SCHEMBL13607364 0.89 ENO1 (0.55) ENO1HDAC6
SCHEMBL23346071 0.81 HDAC6 (0.40) ENO1BRS3HDAC6
SCHEMBL24724733 0.80 ALDH1A1 (0.46) ENO1HDAC6
SCHEMBL21479645 0.77 HDAC6 (0.40) ENO1BRS3HDAC6ACACB
SCHEMBL13607362 0.75 ENO1 (0.60) ENO1HDAC6
SCHEMBL2955788 0.73 ADORA2A (0.43) ADORA2AADORA1
SCHEMBL24933040 0.73 LMNA (0.42)
SCHEMBL13815210 0.71 ENO1 (0.58) ENO1HDAC6
SCHEMBL24724746 0.68 CNR2 (0.37) ENO1BRS3

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-2022235699-A2 POTENT ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF IMMUNOGLOBULINS AND OTHER PROTEINS AVILAR THERAPEUTICS, INC. (US) 2022-11-10 WO disclosed