SCHEMBL25473045

SCHEMBL25473045

CC(=O)COCC(F)(F)C(F)F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.41
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
LMNA P02545 4/20 0.36
CES2 O00748 1/20 0.35
GAA P10253 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPK1 P28482 1/20 0.34
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 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
SCHEMBL10289059 0.78 CES2 (0.40) MAPTTDP1ALDH1A1CES2
SCHEMBL17484882 0.76 CES2 (0.39) CES2
SCHEMBL2536484 0.74 POLB (0.43) POLBMAPTTDP1ALDH1A1NPSR1
SCHEMBL648441 0.74 MAPT (0.39) POLBMAPTTDP1ALDH1A1NPSR1
SCHEMBL23447111 0.72 CES2 (0.43) TDP1ALDH1A1CES2GAA
SCHEMBL24305750 0.71 POLB (0.41) POLBMAPTTDP1ALDH1A1NPSR1
SCHEMBL12660072 0.70 CES2 (0.41) TDP1ALDH1A1CES2GAA
SCHEMBL1148785 0.70 MAPT (0.39) POLBMAPTTDP1ALDH1A1NPSR1
SCHEMBL4977247 0.70 MAPK1 (0.35) POLBMAPTTDP1ALDH1A1NPSR1
SCHEMBL14213754 0.70 ALDH1A1 (0.32) TDP1ALDH1A1

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-2023083295-A1 ESTER DERIVATIVES OF N4-HYDROXYCYTIDINE AND USE THEREOF SUZHOU SPRING-SEA BIO-PHARMACEUTICALS CO., LTD. (CN) 2023-05-19 WO disclosed