SCHEMBL29329059

SCHEMBL29329059

CC(C)C(=O)CNC(=O)CC(=O)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
PTGS2 P35354 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
RECQL P46063 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
PSMB5 P28074 3/20 0.32

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
SCHEMBL20017058 0.85 ALDH1A1 (0.41) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL13528709 0.83 MEN1 (0.46) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL29311861 0.81 CA1 (0.35) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL18513246 0.81 RECQL (0.54) ALDH1A1RECQLPSMB5
SCHEMBL13895432 0.81 TERT (0.38) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL13197236 0.81 RECQL (0.48) ALDH1A1MAPTTDP1RECQLPSMB5
SCHEMBL12458168 0.81 PSMB5 (0.49) ALDH1A1LMNATDP1CYP2D6CYP2C19
SCHEMBL18513247 0.81 ALDH1A1 (0.39) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL29329056 0.81 ECE1 (0.39) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL13160840 0.80 MCL1 (0.43) ALDH1A1MAPTCYP2D6CYP2C19

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-12043833-B2 Targeted compositions ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-23 US disclosed