SCHEMBL4123735

SCHEMBL4123735

C=C(CCCC(C)=O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.42
SLC15A2 Q16348 1/20 0.42
PAOX Q6QHF9 3/20 0.41
ACHE P22303 1/20 0.41
TBXAS1 P24557 2/20 0.37
TET2 Q6N021 4/20 0.37
SLC22A6 Q4U2R8 1/20 0.35
TET3 O43151 1/20 0.34
TET1 Q8NFU7 1/20 0.34
THRB P10828 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
PGGT1B P53609 1/20 0.34
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
GRM1 Q13255 1/20 0.33
GRM2 Q14416 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL4133292 0.95 PAOX (0.46) ALDH1A1LMNASLC15A2PAOXACHE
SCHEMBL7989948 0.87 SLC22A6 (0.44) LMNATBXAS1TET2SLC22A6TET3
SCHEMBL5925011 0.85 TBXAS1 (0.37) ALDH1A1LMNASLC15A2TBXAS1TET2
SCHEMBL474841 0.84 ALDH1A1 (0.56) ALDH1A1LMNASLC15A2PAOXACHE
SCHEMBL1224391 0.82 KDM4E (0.50) ALDH1A1LMNASLC15A2TBXAS1TET2
SCHEMBL2025802 0.81 TBXAS1 (0.47) LMNATBXAS1TET2SLC22A6TET3
SCHEMBL17691091 0.79
SCHEMBL33625 0.79 SLC22A6 (0.61) ALDH1A1LMNASLC22A6THRBALOX15
SCHEMBL1860769 0.78 TBXAS1 (0.50) ALDH1A1LMNATBXAS1TET2SLC22A6
SCHEMBL11125055 0.78 TBXAS1 (0.50) ALDH1A1LMNATBXAS1TET2SLC22A6

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
US-8193285-B2 Block copolymers NIPPON SODA CO., LTD. (JP) 2012-06-05 US disclosed
US-20090253867-A1 BLOCK COPOLYMERS NIPPON SODA CO., LTD. (JP) 2009-10-08 US disclosed