SCHEMBL29344409

SCHEMBL29344409

CC(=O)CN(CCN(CC(C)=O)CC(N)=O)CC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.43
EYA2 O00167 1/20 0.43
APP P05067 1/20 0.43
ACE P12821 1/20 0.43
ALOX15 P16050 4/20 0.42
BLM P54132 4/20 0.42
PMP22 Q01453 4/20 0.42
LMNA P02545 3/20 0.42
KDM4E B2RXH2 3/20 0.42
CYP2C19 P33261 2/20 0.42
TSHR P16473 2/20 0.42
CHRM2 P08172 1/20 0.42
ADRA2A P08913 1/20 0.42
DRD1 P21728 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
ADRA1A P35348 1/20 0.42
DRD3 P35462 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL14462553 0.91 TDP1 (0.61) TDP1EYA2APPACEALOX15
SCHEMBL12085022 0.89 TRPA1 (0.40) TDP1ALOX15BLMPMP22LMNA
SCHEMBL1574695 0.89 TDP1 (0.53) TDP1EYA2APPACEALOX15
SCHEMBL3639097 0.89 TDP1 (0.53) TDP1EYA2APPACEALOX15
SCHEMBL3636303 0.86 TDP1 (0.50) TDP1EYA2APPACEALOX15
SCHEMBL12191702 0.86 TDP1 (0.55) TDP1EYA2APPACEALOX15
SCHEMBL2359794 0.86 TDP1 (0.55) TDP1EYA2APPACEALOX15
SCHEMBL18412664 0.83 BLM (0.36) TDP1EYA2APPACEBLM
SCHEMBL27434395 0.82 CHRM2 (0.40) TDP1ALOX15BLMPMP22LMNA
SCHEMBL24864482 0.80

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-2024151890-A1 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2024-07-18 WO disclosed