SCHEMBL8893566

SCHEMBL8893566

[O]C(=O)COC1CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.34
WDR77 Q9BQA1 2/20 0.34
ELANE P08246 1/20 0.34
ATF4 P18848 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
KAT2B Q92831 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
AOC2 O75106 1/20 0.32
CETP P11597 1/20 0.32
DCPS Q96C86 1/20 0.31
PIK3CD O00329 1/20 0.31
PDE4D Q08499 2/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31

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
SCHEMBL360662 0.83 ITGB3 (0.41) PRMT5WDR77ELANEATF4SPHK1
SCHEMBL23386552 0.81 PIK3CD (0.37) PRMT5WDR77ELANEATF4SPHK1
SCHEMBL24158596 0.81 KDM4E (0.36) PRMT5WDR77ELANEATF4SPHK1
SCHEMBL27539170 0.79 SPHK1 (0.37) ELANESPHK1KAT2BBAZ2BPDE4D
SCHEMBL8105483 0.78 ELANE (0.35) PRMT5WDR77ELANEATF4SPHK1
SCHEMBL21617359 0.76 PRMT5 (0.39) PRMT5WDR77ELANEATF4SPHK1
SCHEMBL21576962 0.76 PIK3CD (0.38) PRMT5WDR77ELANEATF4SPHK1
SCHEMBL24158831 0.76 KAT2B (0.42) PRMT5WDR77ELANEATF4KAT2B
SCHEMBL2094603 0.76 KAT2B (0.33) PRMT5WDR77ELANESPHK1KAT2B
SCHEMBL3254867 0.75 TSHR (0.42) L3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618222-A2 Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid CIBA-GEIGY AG (CH) 1994-10-05 EP claimed
US-5643878-A TREATMENT OF RETROVIRAL DISEASES LIKE AIDS CIBA-GEIGY CORPORATION (US) 1997-07-01 US disclosed
CN-1112125-A Acyloxyhexanoic acid derivatives CIBA GEIGY AG (CH) 1995-11-22 CN disclosed
EP-0618222-A2 Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid CIBA-GEIGY AG (CH) 1994-10-05 EP disclosed