SCHEMBL25829543

SCHEMBL25829543

CN(CCO)C(=O)COc1ccc(C(=O)c2ccccc2)c(OCC(=O)N(C)CCO)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.65
PDK2 Q15119 1/20 0.51
HPGD P15428 2/20 0.50
KDM4E B2RXH2 2/20 0.49
MAPK1 P28482 3/20 0.49
MAPT P10636 2/20 0.49
ELANE P08246 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TDP1 Q9NUW8 1/20 0.42
HIF1A Q16665 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
PGR P06401 1/20 0.41
CYP2D6 P10635 1/20 0.41
SLC6A2 P23975 1/20 0.41

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
SCHEMBL25828116 0.88 POLB (0.61) POLBPDK2HPGDKDM4EMAPK1
SCHEMBL25829502 0.85 POLB (0.61) POLBPDK2HPGDKDM4EMAPK1
SCHEMBL16092725 0.79 MEN1 (0.61) POLBHPGDKDM4EMAPK1MAPT
SCHEMBL31006408 0.78 HPGD (0.79) POLBHPGDKDM4EMAPK1MAPT
SCHEMBL25306124 0.78 HPGD (0.79) POLBHPGDKDM4EMAPK1MAPT
SCHEMBL16090169 0.77 POLB (0.63) POLBHPGDKDM4EMAPK1MAPT
SCHEMBL25829494 0.74 HPGD (0.73) POLBHPGDKDM4EMAPK1MAPT
SCHEMBL22221532 0.74 POLB (0.57) POLBPDK2HPGDKDM4EMAPT
SCHEMBL9856196 0.73 POLB (0.76) POLBHPGDKDM4EMAPK1MAPT
SCHEMBL4536547 0.73 POLB (0.61) POLBHPGDKDM4EMAPK1MAPT

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-2023126223-A1 POLYHYDROXYLATED PHOTOINITIATORS ARKEMA FRANCE (FR) 2023-07-06 WO disclosed