SCHEMBL28825142

SCHEMBL28825142

C=C(C)C(=O)OCCOC(=O)Oc1cccc(C(=O)c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.53
STS P08842 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
MAPK1 P28482 2/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
HTT P42858 1/20 0.42
SRD5A2 P31213 1/20 0.42
ATM Q13315 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
SERPINE1 P05121 1/20 0.40
MAOB P27338 1/20 0.39
MAPT P10636 1/20 0.39
PTGS1 P23219 2/20 0.39
PTGS2 P35354 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL28825176 0.95 ELANE (0.51) ELANESTSL3MBTL1TDP1MAPK1
SCHEMBL25283214 0.88 ELANE (0.69) ELANEL3MBTL1TDP1MAPK1LMNA
SCHEMBL28825187 0.88 L3MBTL1 (0.43) ELANESTSL3MBTL1TDP1MAPK1
SCHEMBL3561624 0.85 ELANE (0.50) ELANEL3MBTL1TDP1LMNAPOLB
SCHEMBL23064197 0.84 ELANE (0.66) ELANEL3MBTL1TDP1POLBAPEX1
SCHEMBL671792 0.78 THRB (0.50) ELANETDP1LMNAPOLBAPEX1
SCHEMBL19393303 0.78 ELANE (0.49) ELANETDP1LMNAPOLBAPEX1
SCHEMBL1067982 0.78 HTT (0.64) ELANEL3MBTL1TDP1MAPK1LMNA
SCHEMBL28825192 0.77 HPGD (0.57) ELANEL3MBTL1TDP1MAPK1LMNA
SCHEMBL5314324 0.76 ELANE (0.70) ELANESTSL3MBTL1TDP1MAPK1

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
CN-114805133-A Aryl chloroformate preparation method 苏州星日化学有限公司 2022-07-29 CN disclosed