SCHEMBL24675784

SCHEMBL24675784

CC(CCC(=O)N(C)C=O)N1Cc2c(N)cccc2C1=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
TNF P01375 1/20 0.35
IL1B P01584 1/20 0.35
IKZF1 Q13422 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
IKZF3 Q9UKT9 1/20 0.35
PABPC1 P11940 1/20 0.35
PAX8 Q06710 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ALOX15 P16050 1/20 0.31
MLNR O43193 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
THRB P10828 1/20 0.30
LMNA P02545 1/20 0.30
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
TLR9 Q9NR96 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
SCHEMBL18666649 0.83 BRD4 (0.35) BRD4TNFIL1BIKZF1DDB1
SCHEMBL21986280 0.81 BRD4 (0.38) BRD4TNFIL1BIKZF1DDB1
SCHEMBL19934106 0.79 TNF (0.42) TNFPABPC1KDM4ELMNA
SCHEMBL24816670 0.78 CRBN (0.33) CRBN
SCHEMBL9934296 0.77 BRD4 (0.40) BRD4TNFIL1BIKZF1DDB1
SCHEMBL22940430 0.75 PAX8 (0.31) PAX8
SCHEMBL7850519 0.73 TNF (0.35) BRD4TNFIL1BIKZF1DDB1
SCHEMBL9934235 0.73 UGCG (0.39) BRD4TNFIL1BIKZF1DDB1
SCHEMBL9935368 0.73 UGCG (0.39) BRD4TNFIL1BIKZF1DDB1
SCHEMBL7952458 0.73 IDH1 (0.46) BRD4TNFIL1BIKZF1DDB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022159688-A9 DEGRADERS OF GRK2 AND USES THEREOF SONATA THERAPEUTICS, INC. (US) 2023-09-21 WO disclosed
WO-2022159688-A1 DEGRADERS OF GRK2 AND USES THEREOF CYGNAL THERAPEUTICS, INC. (US) 2022-07-28 WO disclosed