Levulinic Acid

Levulinic Acid

SCHEMBL27598664

C1COCCO1.CC(=O)CCC(=O)O

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.70
SLC15A2 Q16348 1/20 0.70
ALDH1A1 P00352 1/20 0.50
EGLN1 Q9GZT9 6/20 0.46
PHF8 Q9UPP1 5/20 0.46
KDM2A Q9Y2K7 5/20 0.46
KDM5C P41229 4/20 0.46
KDM4E B2RXH2 3/20 0.46
KDM6B O15054 3/20 0.46
ALKBH5 Q6P6C2 1/20 0.45
SUCNR1 Q9BXA5 1/20 0.45
GLA P06280 1/20 0.43
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
FFAR3 O14843 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
MAPK1 P28482 1/20 0.36

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
Levulinic Acid SCHEMBL2634413 0.93 LMNA (0.67) LMNASLC15A2ALDH1A1EGLN1PHF8
Levulinic Acid SCHEMBL2634416 0.91 LMNA (0.64) LMNASLC15A2ALDH1A1EGLN1PHF8
Dioxane SCHEMBL27857795 0.89 ALDH1A1 (0.62) LMNASLC15A2ALDH1A1KDM4EGLA
Succinic Acid SCHEMBL28079111 0.87 LMNA (0.60) LMNASLC15A2EGLN1PHF8KDM2A
Levulinic Acid SCHEMBL27931545 0.84 LMNA (1.00) LMNASLC15A2ALDH1A1EGLN1PHF8
Levulinic Acid SCHEMBL30530258 0.84
Levulinic Acid SCHEMBL113572 0.84 LMNA (1.00) LMNASLC15A2ALDH1A1EGLN1PHF8
Levulinic Acid SCHEMBL20868 0.84
Succinic Acid SCHEMBL31697590 0.84 LMNA (0.64) LMNASLC15A2EGLN1PHF8KDM2A
Succinic Acid SCHEMBL7766385 0.84 LMNA (0.64) LMNASLC15A2EGLN1PHF8KDM2A

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-1498215-A Process for preparing 5-methylbuty rolactone from levalinic acid 纳幕尔杜邦公司 2004-05-19 CN disclosed