SCHEMBL7634067

SCHEMBL7634067

COC(=O)C(/C=N\O)CCCC(C)C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.36
GAA P10253 1/20 0.35
BLM P54132 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
FOLH1 Q04609 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.32
KDM1A O60341 1/20 0.31
MIF P14174 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MME P08473 1/20 0.30
LMNA P02545 1/20 0.30
BIRC2 Q13490 2/20 0.30

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
SCHEMBL7643886 0.97 ZDHHC7 (0.35) PTPN1GAABLMCA1CA2
SCHEMBL7641292 0.95 ZDHHC7 (0.38) PTPN1GAABLMCA1CA2
SCHEMBL7634809 0.89 GAA (0.36) GAACA1CA2FOLH1ZDHHC7
SCHEMBL7642987 0.85 PTPN1 (0.35) PTPN1BLM
SCHEMBL7634886 0.85 PTPN1 (0.35) PTPN1BLMSMN1; SMN2
SCHEMBL7641192 0.84 CA1 (0.50) GAACA1CA2ZDHHC7LMNA
SCHEMBL7637003 0.83 ZDHHC7 (0.50) GAACA1CA2ZDHHC7LMNA
SCHEMBL7636000 0.81 ZDHHC7 (0.53) CA1CA2ZDHHC7LMNABIRC2
SCHEMBL7637924 0.81 ZDHHC7 (0.53) CA1CA2ZDHHC7LMNABIRC2
SCHEMBL7641892 0.81 ZDHHC7 (0.53) CA1CA2ZDHHC7LMNABIRC2

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-6348617-B1 REACTING PYRUVIC ACID COMPOUND IN WATER WITH AMMONIUM OR ALKALI METAL BISULFITE TO GIVE AQUEOUS SOLUTION OF BISULFITE ADDUCT, ISOLATING BY PHASE SEPARATION, OPTIONALLY USING HYDROPHOBIC SOLVENT, CONTACTING WITH ACID TO DECOMPOSE ADDUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-19 US disclosed
EP-0937703-A1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-25 EP disclosed