SCHEMBL28463565

SCHEMBL28463565

CC(C)(C)OC(=O)c1ccccc1OCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
HIF1A Q16665 1/20 0.50
LMNA P02545 4/20 0.48
MAPT P10636 3/20 0.48
NR1I2 O75469 1/20 0.48
CHRM2 P08172 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADRA2A P08913 1/20 0.48
OPRK1 P41145 1/20 0.48
HTR2B P41595 1/20 0.48
SLC6A3 Q01959 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
LTB4R Q15722 1/20 0.46
LTB4R2 Q9NPC1 1/20 0.46
CNR2 P34972 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSP90AA1 P07900 1/20 0.44

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
SCHEMBL8642467 0.86 LMNA (0.65) ALDH1A1KMT2AMEN1NPSR1LMNA
SCHEMBL23970739 0.85 LMNA (0.49) ALDH1A1KMT2AMEN1NPSR1LMNA
SCHEMBL30159042 0.83 LMNA (0.48) ALDH1A1KMT2AMEN1NPSR1LMNA
SCHEMBL23971030 0.83 LMNA (0.48) ALDH1A1KMT2AMEN1NPSR1LMNA
SCHEMBL28020523 0.83 LMNA (0.56) ALDH1A1KMT2AMEN1NPSR1HIF1A
SCHEMBL5145231 0.81 LMNA (0.68) ALDH1A1KMT2AMEN1NPSR1HIF1A
SCHEMBL934896 0.81 ADRB2 (0.54) ALDH1A1KMT2AMEN1NPSR1HIF1A
SCHEMBL4266953 0.81 LMNA (0.68) ALDH1A1KMT2AMEN1NPSR1HIF1A
SCHEMBL19717846 0.81 ALDH1A1 (0.65) ALDH1A1KMT2AMEN1NPSR1HIF1A
SCHEMBL2517739 0.81 ALDH1A1 (0.65) ALDH1A1KMT2AMEN1NPSR1HIF1A

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-111560060-A Double acylated GLP-1 derivatives 诺沃—诺迪斯克有限公司 2020-08-21 CN disclosed