SCHEMBL30458207

SCHEMBL30458207

[2H]C(OCCOCCOC(=O)C(=O)c1ccccc1)(C(=O)O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
KMT2A Q03164 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAPT P10636 2/20 0.35
GAA P10253 1/20 0.35
PTGS1 P23219 2/20 0.35
PTGS2 P35354 2/20 0.35
CES2 O00748 2/20 0.33
CES1 P23141 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SLC6A3 Q01959 2/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 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
SCHEMBL29277808 0.84 KDM4E (0.40) KDM4ETDP1SMN1; SMN2ALDH1A1MAPT
SCHEMBL665971 0.81 CES2 (0.50) KDM4EKMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL3312136 0.81 CES2 (0.50) KDM4EKMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL30478610 0.81 CES2 (0.50) KDM4EKMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL13982035 0.81 CES2 (0.50) KDM4EKMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL29026525 0.80 GLS (0.38) KDM4ESMN1; SMN2ALDH1A1MAPTGAA
SCHEMBL220962 0.78 LMNA (0.45) KDM4EKMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL29194859 0.77 GLS (0.38) KDM4EKMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL4738627 0.76 CES2 (0.56) KDM4EKMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL194429 0.75 SMN1; SMN2 (0.45) KDM4EKMT2ATDP1SMN1; SMN2ALDH1A1

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
CN-116348295-A Ultraviolet curable resin composition 电化株式会社 2023-06-27 CN disclosed
CN-116323200-A Ultraviolet curable resin composition 电化株式会社 2023-06-23 CN disclosed