SCHEMBL21885953

SCHEMBL21885953

CC(C)NS(=O)(=O)CC1CCN(C)C(=O)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 7/20 0.39
HTR5A P47898 1/20 0.33
MAPK1 P28482 1/20 0.32
PIK3CD O00329 1/20 0.31
ACACB O00763 1/20 0.31
BRD2 P25440 1/20 0.31
KAT6A Q92794 1/20 0.31
KAT5 Q92993 1/20 0.31
KAT8 Q9H7Z6 1/20 0.31

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
SCHEMBL12424595 0.77 BRD4 (0.47) BRD4HTR5AMAPK1PIK3CDBRD2
SCHEMBL23132786 0.77 BRD4 (0.47) BRD4HTR5AMAPK1PIK3CDBRD2
SCHEMBL21827039 0.76 BRD4 (0.41) BRD4HTR5ABRD2
SCHEMBL23868226 0.75 ACACB (0.38) ACACBKAT8
SCHEMBL8091841 0.73 ACACB (0.42) ACACB
SCHEMBL19570437 0.73 BRD4 (0.43) BRD4HTR5AMAPK1PIK3CDBRD2
SCHEMBL16095176 0.72 BRD4 (0.46) BRD4HTR5AMAPK1PIK3CDBRD2
SCHEMBL16000112 0.71 ACACB (0.38) ACACB
SCHEMBL16000131 0.70 ACACB (0.38) ACACB
SCHEMBL21593760 0.70 HTR5A (0.44) BRD4HTR5AMAPK1PIK3CD

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-2020073011-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY ANNAPURNA BIO, INC. (US) 2020-04-09 WO disclosed