SCHEMBL6520401

SCHEMBL6520401

O=C(O)CCCn1c(=O)[nH]c(=O)n(CCCC(=O)O)c1=O

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.78
KDM4E B2RXH2 4/20 0.54
HSD17B10 Q99714 2/20 0.54
MAPK1 P28482 1/20 0.54
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.46
FABP4 P15090 2/20 0.44
FABP5 Q01469 2/20 0.44
HPGD P15428 2/20 0.41
GAA P10253 1/20 0.39
PNP P00491 1/20 0.39
PTGS1 P23219 4/20 0.39
PTGS2 P35354 4/20 0.39

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
SCHEMBL29251517 0.89 APEX1 (0.62) APEX1KDM4EHSD17B10MAPK1ALDH1A1
SCHEMBL677227 0.88 APEX1 (1.00) APEX1KDM4EHSD17B10MAPK1ALDH1A1
SCHEMBL411981 0.85 APEX1 (0.54) APEX1KDM4EHSD17B10MAPK1FABP4
SCHEMBL4185101 0.84 APEX1 (0.55) APEX1KDM4EHSD17B10MAPK1ALDH1A1
SCHEMBL29251518 0.84 APEX1 (0.77) APEX1KDM4EHSD17B10MAPK1ALDH1A1
SCHEMBL29251524 0.79 APEX1 (0.82) APEX1KDM4EHSD17B10MAPK1ALDH1A1
SCHEMBL7344985 0.79 KDM4E (0.49) APEX1KDM4EHSD17B10MAPK1ALDH1A1
SCHEMBL25465028 0.79 PTGS1 (0.53) APEX1FABP4FABP5GAAPNP
SCHEMBL30976974 0.78 APEX1 (0.47) APEX1KDM4EHSD17B10MAPK1FABP4
SCHEMBL29251522 0.77 APEX1 (0.79) APEX1KDM4EHSD17B10MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6841305-B2 High temperature, storage stability MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2005-01-11 US disclosed
US-20020009652-A1 High temperature, storage stability MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2002-01-24 US disclosed
EP-1160899-A2 Non-aqueous electrolyte battery and non-aqueous electrolyte MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2001-12-05 EP disclosed