SCHEMBL26601477

SCHEMBL26601477

COC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)c1ccccc1OC(F)F

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 8/20 0.49
TDP1 Q9NUW8 8/20 0.49
MAPT P10636 5/20 0.49
ATM Q13315 2/20 0.48
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
ALDH1A1 P00352 1/20 0.48
PAX8 Q06710 1/20 0.48
POLB P06746 4/20 0.47
KDM4E B2RXH2 2/20 0.47

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
SCHEMBL31457364 0.91 NPSR1 (0.47) NPSR1TDP1MAPTATMMEN1
SCHEMBL31676238 0.89 NPSR1 (0.46) NPSR1TDP1MAPTATMMEN1
SCHEMBL26632733 0.81 CNR2 (0.54) KMT2AALDH1A1
SCHEMBL19982954 0.81 TDP1 (0.53) NPSR1TDP1MAPTATMMEN1
SCHEMBL19983040 0.80 TDP1 (0.53) NPSR1TDP1MAPTATMMEN1
SCHEMBL19983072 0.79 TDP1 (0.53) NPSR1TDP1MAPTATMMEN1
SCHEMBL12708216 0.77 KCNA5 (0.46) NPSR1TDP1MAPTATMMEN1
SCHEMBL21153191 0.77 TDP1 (0.51) NPSR1TDP1MAPTATMMEN1
SCHEMBL7545229 0.77 TDP1 (0.52) NPSR1TDP1MAPTATMMEN1
SCHEMBL7544858 0.77 TDP1 (0.52) NPSR1TDP1MAPTATMMEN1

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-2023205219-A1 PROTEOLYSIS TARGETING CHIMERA (PROTAC) COMPOSITIONS USING UBIQUITIN CONJUGATING ENZYME LIGANDS BERG LLC (US) 2023-10-26 WO disclosed