SCHEMBL7636866

SCHEMBL7636866

CC(=O)C(CCCCCC(C)C)C(=O)OC(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.39
TSHR P16473 1/20 0.37
LMNA P02545 3/20 0.35
TRPV1 Q8NER1 1/20 0.35
PTPN1 P18031 1/20 0.34
KDM4C Q9H3R0 2/20 0.33
KDM4A O75164 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
BLM P54132 1/20 0.32
RARB P10826 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
ZDHHC7 Q9NXF8 1/20 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
SCHEMBL7636863 0.98 TSHR (0.38) FAAHTSHRLMNATRPV1PTPN1
SCHEMBL7643066 0.94 PTPN1 (0.38) FAAHTSHRLMNAPTPN1BLM
SCHEMBL7635608 0.87 FAAH (0.53) FAAHLMNAZDHHC7
SCHEMBL7641729 0.87 FAAH (0.53) FAAHLMNAZDHHC7
SCHEMBL7637304 0.87 FAAH (0.53) FAAHLMNAZDHHC7
SCHEMBL7637071 0.86 TSHR (0.41) FAAHTSHRLMNAPTPN1TDP1
SCHEMBL7634025 0.86 FAAH (0.41) FAAHTSHRLMNATRPV1ZDHHC7
SCHEMBL7642736 0.86 FAAH (0.37) FAAHTSHRLMNATRPV1
SCHEMBL7644128 0.85 FAAH (0.50) FAAHLMNAZDHHC7
SCHEMBL7641997 0.83 ZDHHC7 (0.42) FAAHTSHRLMNATRPV1PTPN1

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