SCHEMBL7642987

SCHEMBL7642987

CC(C)CCCC(/C=N\O)C(=O)OC(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.35
BLM P54132 1/20 0.33
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7637346 0.97 PTPN1 (0.32) PTPN1BLMTDP1
SCHEMBL7643110 0.95 LMNA (0.32) PTPN1TDP1
SCHEMBL7636882 0.90 TDP1 (0.33) TDP1
SCHEMBL7635554 0.87 LMNA (0.40) TDP1
SCHEMBL7640147 0.85 LMNA (0.42)
SCHEMBL7634067 0.85 PTPN1 (0.36) PTPN1BLM
SCHEMBL7642184 0.84 LMNA (0.45)
SCHEMBL7641189 0.84 LMNA (0.45)
SCHEMBL7643155 0.84 LMNA (0.45)
SCHEMBL7634886 0.83 PTPN1 (0.35) PTPN1BLM

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