SCHEMBL4749440

SCHEMBL4749440

C[C@@H]1C[C@@H]([C@H](O)CO)OC1=O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
HIF1A Q16665 2/20 0.42
MANBA O00462 1/20 0.42
THRB P10828 1/20 0.42
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2C19 P33261 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
SCHEMBL8149511 1.00 LMNA (0.42) LMNAHIF1AMANBATHRBMAPT
SCHEMBL17822599 0.85 TLR7 (0.36) LMNAHIF1AMANBATHRB
SCHEMBL7150099 0.81 LMNA (0.46) LMNAHIF1AMANBATHRBMAPT
SCHEMBL12239952 0.81 LMNA (0.46) LMNAHIF1AMANBATHRBMAPT
SCHEMBL7150023 0.81 LMNA (0.46) LMNAHIF1AMANBATHRBMAPT
SCHEMBL7153061 0.81 LMNA (0.46) LMNAHIF1AMANBATHRBMAPT
SCHEMBL7955722 0.80 POLB (0.40) LMNAHIF1AMANBATHRBMAPT
SCHEMBL4788721 0.80 LMNA (0.39) LMNAHIF1AMANBATHRBMAPT
SCHEMBL3265510 0.80 POLB (0.40) LMNAHIF1AMANBATHRBMAPT
SCHEMBL3230903 0.80 LMNA (0.39) LMNAHIF1AMANBATHRBMAPT

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
WO-2010024772-A1 ASPARTYL PROTEASE INHIBITORS MEDIVIR AB (SE) 2010-03-04 WO disclosed
WO-2008119772-A1 AMIDE DERIVATIVES AS INHIBITORS OF ASPARTYL PROTEASES MEDIVIR AB (SE) 2008-10-09 WO disclosed