SCHEMBL7640147

SCHEMBL7640147

CCCCCC(/C=N\O)C(=O)OC(C)C

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
FAAH O00519 5/20 0.39
CA1 P00915 2/20 0.37
ZDHHC7 Q9NXF8 1/20 0.37
CTSK P43235 1/20 0.36
ABCB1 P08183 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ACE2 Q9BYF1 1/20 0.34
BIRC2 Q13490 2/20 0.34

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
SCHEMBL7642184 0.98 LMNA (0.45) LMNAFAAHCA1ZDHHC7CTSK
SCHEMBL7643155 0.98 LMNA (0.45) LMNAFAAHCA1ZDHHC7CTSK
SCHEMBL7641189 0.98 LMNA (0.45) LMNAFAAHCA1ZDHHC7CTSK
SCHEMBL7635554 0.95 LMNA (0.40) LMNAFAAHCA1CTSKALDH1A1
SCHEMBL7637346 0.89 PTPN1 (0.32)
SCHEMBL7635360 0.88 LMNA (0.34) LMNACTSK
SCHEMBL7643110 0.87 LMNA (0.32) LMNA
SCHEMBL7642987 0.85 PTPN1 (0.35)
SCHEMBL7637003 0.83 ZDHHC7 (0.50) LMNACA1ZDHHC7ABCB1BIRC2
SCHEMBL7640237 0.83 ZDHHC7 (0.39) FAAHCA1ZDHHC7

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